Organoheterocyclic compounds

Organic compounds that consist of ring structures, or cyclic compounds that have atoms of at least two different elements as members of its ring(s).

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1,501 – 1,515 of 195,600 results

1,501

Methyle2-chloro-6-methylpyrimidine-4-carboxylate, 97%, Thermo Scientific™

CAS: 89793-11-3 Molecular Formula: C7H7ClN2O2 Molecular Weight (g/mol): 186.595 MDL Number: MFCD00117906 InChI Key: ZNPORLVPCMFKOR-UHFFFAOYSA-N Synonym: methyl2-chloro-6-methylpyrimidine-4-carboxylate,methyl 2-chloro-4-methylpyrimidine-6-carboxylate,methyl 2-chloro-6-methyl-pyrimidine-4-carboxylate,4-pyrimidinecarboxylic acid, 2-chloro-6-methyl-, methyl ester,2-chloro-4-methoxycarbonyl-6-methylpyrimidine,2-chloro-6-methyl-pyrimidine-4-carboxylic acid methyl ester,acmc-20akio,2-chloro-4-carbomethoxy-6-methylpyrimidine,methyl 2-chloro-6-methylpyrimidine 4-carboxylate,methyl-2-chloro-6-methylpyrimidine-4-carboxylate PubChem CID: 2736835 IUPAC Name: methyl 2-chloro-6-methylpyrimidine-4-carboxylate SMILES: CC1=NC(=NC(=C1)C(=O)OC)Cl

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Specifications

PubChem CID	2736835
CAS	89793-11-3
Molecular Weight (g/mol)	186.595
MDL Number	MFCD00117906
SMILES	CC1=NC(=NC(=C1)C(=O)OC)Cl
Synonym	methyl2-chloro-6-methylpyrimidine-4-carboxylate,methyl 2-chloro-4-methylpyrimidine-6-carboxylate,methyl 2-chloro-6-methyl-pyrimidine-4-carboxylate,4-pyrimidinecarboxylic acid, 2-chloro-6-methyl-, methyl ester,2-chloro-4-methoxycarbonyl-6-methylpyrimidine,2-chloro-6-methyl-pyrimidine-4-carboxylic acid methyl ester,acmc-20akio,2-chloro-4-carbomethoxy-6-methylpyrimidine,methyl 2-chloro-6-methylpyrimidine 4-carboxylate,methyl-2-chloro-6-methylpyrimidine-4-carboxylate
IUPAC Name	methyl 2-chloro-6-methylpyrimidine-4-carboxylate
InChI Key	ZNPORLVPCMFKOR-UHFFFAOYSA-N
Molecular Formula	C7H7ClN2O2

1,502

Thiamine Mononitrate, USP, 98-102%, Spectrum™ Chemical

CAS: 532-43-4 Molecular Formula: C12H17N5O4S Molecular Weight (g/mol): 327.36 MDL Number: MFCD00036330 InChI Key: UIERGBJEBXXIGO-UHFFFAOYSA-N IUPAC Name: 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(2-hydroxyethyl)-4-methyl-3H-1λ⁴,3-thiazol-1-ylium nitrate SMILES: [O-][N+]([O-])=O.CC1=C(CCO)[S+]=CN1CC1=CN=C(C)N=C1N

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Specifications

CAS	532-43-4
Molecular Weight (g/mol)	327.36
MDL Number	MFCD00036330
SMILES	[O-][N+]([O-])=O.CC1=C(CCO)[S+]=CN1CC1=CN=C(C)N=C1N
IUPAC Name	3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(2-hydroxyethyl)-4-methyl-3H-1λ⁴,3-thiazol-1-ylium nitrate
InChI Key	UIERGBJEBXXIGO-UHFFFAOYSA-N
Molecular Formula	C12H17N5O4S

1,503

Methyle2-chloro-4-(trifluoromethyl)pyrimidine-5-carboxylate, 97%, Thermo Scientific™

CAS: 175137-27-6 Molecular Formula: C7H4ClF3N2O2 Molecular Weight (g/mol): 240.57 MDL Number: MFCD00068146 InChI Key: VLUBJYUOPNGBOQ-UHFFFAOYSA-N Synonym: methyl 2-chloro-4-trifluoromethyl pyrimidine-5-carboxylate,methyl 2-chloro-4-trifluoromethyl-5-pyrimidinecarboxylate,methylchlorotrifluoromethylpyrimidinecarboxylate,methyl-2-chloro-4-trifluoromethyl pyrimidine-5-carboxylate,acmc-20aifi,pubchem10174,2-chloro-4-trifluoromethyl-5-carbomethoxypyrimidine,methyl 2-chloro-4-trifluoromethyl pyrimidine-5-ca,2-chloro-5-methoxycarbonyl-4-trifluoromethylpyrimidine,2-chloro-5-methoxycarbonyl-4-trifluoromethyl pyrimidine PubChem CID: 3696469 IUPAC Name: methyl 2-chloro-4-(trifluoromethyl)pyrimidine-5-carboxylate SMILES: COC(=O)C1=CN=C(Cl)N=C1C(F)(F)F

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Specifications

PubChem CID	3696469
CAS	175137-27-6
Molecular Weight (g/mol)	240.57
MDL Number	MFCD00068146
SMILES	COC(=O)C1=CN=C(Cl)N=C1C(F)(F)F
Synonym	methyl 2-chloro-4-trifluoromethyl pyrimidine-5-carboxylate,methyl 2-chloro-4-trifluoromethyl-5-pyrimidinecarboxylate,methylchlorotrifluoromethylpyrimidinecarboxylate,methyl-2-chloro-4-trifluoromethyl pyrimidine-5-carboxylate,acmc-20aifi,pubchem10174,2-chloro-4-trifluoromethyl-5-carbomethoxypyrimidine,methyl 2-chloro-4-trifluoromethyl pyrimidine-5-ca,2-chloro-5-methoxycarbonyl-4-trifluoromethylpyrimidine,2-chloro-5-methoxycarbonyl-4-trifluoromethyl pyrimidine
IUPAC Name	methyl 2-chloro-4-(trifluoromethyl)pyrimidine-5-carboxylate
InChI Key	VLUBJYUOPNGBOQ-UHFFFAOYSA-N
Molecular Formula	C7H4ClF3N2O2

1,504

2-Pyrid-4-ylpyrimidine-5-carboxylic acid, 90%, Thermo Scientific™

CAS: 259807-47-1 Molecular Formula: C10H7N3O2 Molecular Weight (g/mol): 201.185 MDL Number: MFCD09863218 InChI Key: GTKJGOOMSODGOU-UHFFFAOYSA-N Synonym: 2-pyridin-4-yl pyrimidine-5-carboxylic acid,2-pyrid-4-ylpyrimidine-5-carboxylic acid,5-pyrimidinecarboxylicacid, 2-4-pyridinyl,2-4-pyridyl pyrimidine-5-carboxylic acid,2-4-pyridinyl-5-pyrimidinecarboxylic acid,2-pyridin-4-yl-pyrimidine-5-carboxylic acid,5-pyrimidinecarboxylic acid, 2-4-pyridinyl,5-pyrimidinecarboxylic acid, 2-4-pyridinyl-9ci PubChem CID: 22710213 IUPAC Name: 2-pyridin-4-ylpyrimidine-5-carboxylic acid SMILES: C1=CN=CC=C1C2=NC=C(C=N2)C(=O)O

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Specifications

PubChem CID	22710213
CAS	259807-47-1
Molecular Weight (g/mol)	201.185
MDL Number	MFCD09863218
SMILES	C1=CN=CC=C1C2=NC=C(C=N2)C(=O)O
Synonym	2-pyridin-4-yl pyrimidine-5-carboxylic acid,2-pyrid-4-ylpyrimidine-5-carboxylic acid,5-pyrimidinecarboxylicacid, 2-4-pyridinyl,2-4-pyridyl pyrimidine-5-carboxylic acid,2-4-pyridinyl-5-pyrimidinecarboxylic acid,2-pyridin-4-yl-pyrimidine-5-carboxylic acid,5-pyrimidinecarboxylic acid, 2-4-pyridinyl,5-pyrimidinecarboxylic acid, 2-4-pyridinyl-9ci
IUPAC Name	2-pyridin-4-ylpyrimidine-5-carboxylic acid
InChI Key	GTKJGOOMSODGOU-UHFFFAOYSA-N
Molecular Formula	C10H7N3O2

1,505

Thiamine nitrate

CAS: 532-43-4 Molecular Formula: C12H17N5O4S Molecular Weight (g/mol): 327.36 MDL Number: MFCD00036330 InChI Key: UIERGBJEBXXIGO-UHFFFAOYSA-N Synonym: thiamine nitrate,thiamine mononitrate,vitamin b1 nitrate,vitamin b1 mononitrate,aneurine mononitrate,aneurine nitrate,betabion mononitrate,thiamine nitrate salt,vitamin b sub 1 nitrate,thiamine mononitrate usp PubChem CID: 10762 IUPAC Name: 2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol;nitrate SMILES: [O-][N+]([O-])=O.CC1=C(CCO)[S+]=CN1CC1=CN=C(C)N=C1N

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Specifications

PubChem CID	10762
CAS	532-43-4
Molecular Weight (g/mol)	327.36
MDL Number	MFCD00036330
SMILES	[O-][N+]([O-])=O.CC1=C(CCO)[S+]=CN1CC1=CN=C(C)N=C1N
Synonym	thiamine nitrate,thiamine mononitrate,vitamin b1 nitrate,vitamin b1 mononitrate,aneurine mononitrate,aneurine nitrate,betabion mononitrate,thiamine nitrate salt,vitamin b sub 1 nitrate,thiamine mononitrate usp
IUPAC Name	2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol;nitrate
InChI Key	UIERGBJEBXXIGO-UHFFFAOYSA-N
Molecular Formula	C12H17N5O4S

1,506

2-Amino-4-chloro-6-methoxypyrimidine, 95%, Thermo Scientific™

CAS: 5734-64-5 Molecular Formula: C5H6ClN3O Molecular Weight (g/mol): 159.57 MDL Number: MFCD00233535 InChI Key: VFEYBTFCBZMBAU-UHFFFAOYSA-N Synonym: 2-amino-4-chloro-6-methoxypyrimidine,2-pyrimidinamine, 4-chloro-6-methoxy,2-amino-6-chloro-4-methoxypyrimidine,pyrimidine, 2-amino-4-chloro-6-methoxy,2-amino-4-methoxy-6-chloro pyrimidine,4-chloro-6-methoxy-2-pyrimidinamine,2-amino-4-chloro-6-methoxylpyrimidine,2-amino-4-chloro-6-methoxy pyrimidine,2-amino-4-chloro-6-methoxy-pyrimidine,4-chloro-6-methoxy-pyrimidin-2-ylamine PubChem CID: 79811 IUPAC Name: 4-chloro-6-methoxypyrimidin-2-amine SMILES: COC1=CC(Cl)=NC(N)=N1

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Specifications

PubChem CID	79811
CAS	5734-64-5
Molecular Weight (g/mol)	159.57
MDL Number	MFCD00233535
SMILES	COC1=CC(Cl)=NC(N)=N1
Synonym	2-amino-4-chloro-6-methoxypyrimidine,2-pyrimidinamine, 4-chloro-6-methoxy,2-amino-6-chloro-4-methoxypyrimidine,pyrimidine, 2-amino-4-chloro-6-methoxy,2-amino-4-methoxy-6-chloro pyrimidine,4-chloro-6-methoxy-2-pyrimidinamine,2-amino-4-chloro-6-methoxylpyrimidine,2-amino-4-chloro-6-methoxy pyrimidine,2-amino-4-chloro-6-methoxy-pyrimidine,4-chloro-6-methoxy-pyrimidin-2-ylamine
IUPAC Name	4-chloro-6-methoxypyrimidin-2-amine
InChI Key	VFEYBTFCBZMBAU-UHFFFAOYSA-N
Molecular Formula	C5H6ClN3O

1,507

7-Bromo-6-chloro-7-deazapurine, 97%, Thermo Scientific Chemicals

CAS: 22276-95-5 Molecular Formula: C6H3BrClN3 Molecular Weight (g/mol): 232.465 MDL Number: MFCD09702029 InChI Key: OXLMTRZWMHIZBY-UHFFFAOYSA-N Synonym: 5-bromo-4-chloro-7h-pyrrolo 2,3-d pyrimidine,7-bromo-6-chloro-7-deazapurine,4-chloro-5-bromo-7h-pyrrolo 2,3-d pyrimidine,7h-pyrrolo 2,3-d pyrimidine, 5-bromo-4-chloro,7-deaza-7-bromo-6-chloropurine,5-bromo-4-chloropyrrolo 2,3-d pyrimidine,5-bromo-4-chloro-1h-pyrrolo 2,3-d pyrimidine,7-bromo-5-chloro-2,4,9-triazabicyclo 4.3.0 nona-2,4,7,10-tetraene,pubchem14950,acmc-209zzo PubChem CID: 5380710 IUPAC Name: 5-bromo-4-chloro-7H-pyrrolo[2,3-d]pyrimidine SMILES: C1=C(C2=C(N1)N=CN=C2Cl)Br

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Specifications

PubChem CID	5380710
CAS	22276-95-5
Molecular Weight (g/mol)	232.465
MDL Number	MFCD09702029
SMILES	C1=C(C2=C(N1)N=CN=C2Cl)Br
Synonym	5-bromo-4-chloro-7h-pyrrolo 2,3-d pyrimidine,7-bromo-6-chloro-7-deazapurine,4-chloro-5-bromo-7h-pyrrolo 2,3-d pyrimidine,7h-pyrrolo 2,3-d pyrimidine, 5-bromo-4-chloro,7-deaza-7-bromo-6-chloropurine,5-bromo-4-chloropyrrolo 2,3-d pyrimidine,5-bromo-4-chloro-1h-pyrrolo 2,3-d pyrimidine,7-bromo-5-chloro-2,4,9-triazabicyclo 4.3.0 nona-2,4,7,10-tetraene,pubchem14950,acmc-209zzo
IUPAC Name	5-bromo-4-chloro-7H-pyrrolo[2,3-d]pyrimidine
InChI Key	OXLMTRZWMHIZBY-UHFFFAOYSA-N
Molecular Formula	C6H3BrClN3

1,508

2-Aminopyrimidine, 98%

CAS: 109-12-6 Molecular Formula: C4H5N3 Molecular Weight (g/mol): 95.11 MDL Number: MFCD00006089 InChI Key: LJXQPZWIHJMPQQ-UHFFFAOYSA-N Synonym: 2-aminopyrimidine,2-pyrimidinamine,pyrimidin-2-ylamine,pyrimidinamine,aminopyrimidine,2-pyrimidiylamine,pyrimidine, 2-amino,2-pyridiylamine,1,2-dihydro-2-iminopyrimidine,pyrimidine, amino PubChem CID: 7978 ChEBI: CHEBI:38618 IUPAC Name: pyrimidin-2-amine SMILES: NC1=NC=CC=N1

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Specifications

PubChem CID	7978
CAS	109-12-6
Molecular Weight (g/mol)	95.11
ChEBI	CHEBI:38618
MDL Number	MFCD00006089
SMILES	NC1=NC=CC=N1
Synonym	2-aminopyrimidine,2-pyrimidinamine,pyrimidin-2-ylamine,pyrimidinamine,aminopyrimidine,2-pyrimidiylamine,pyrimidine, 2-amino,2-pyridiylamine,1,2-dihydro-2-iminopyrimidine,pyrimidine, amino
IUPAC Name	pyrimidin-2-amine
InChI Key	LJXQPZWIHJMPQQ-UHFFFAOYSA-N
Molecular Formula	C4H5N3

1,509

2-Mercaptopyrimidine, 98%

CAS: 1450-85-7 Molecular Formula: C₄H₄N₂S Molecular Weight (g/mol): 112.15 MDL Number: MFCD00006073 InChI Key: HBCQSNAFLVXVAY-UHFFFAOYSA-N Synonym: 2-mercaptopyrimidine,pyrimidine-2-thiol,2-pyrimidinethiol,2-thiopyrimidine,pyrimidine-2 1h-thione,2 1h-pyrimidinethione,pyrimidinethione,2-pyrimidinethione,2-pyrimidinethiol 9ci,2-1h-pyrimidinthione PubChem CID: 1550489 ChEBI: CHEBI:53576 IUPAC Name: 1H-pyrimidine-2-thione SMILES: C1=CNC(=S)N=C1

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Specifications

PubChem CID	1550489
CAS	1450-85-7
Molecular Weight (g/mol)	112.15
ChEBI	CHEBI:53576
MDL Number	MFCD00006073
SMILES	C1=CNC(=S)N=C1
Synonym	2-mercaptopyrimidine,pyrimidine-2-thiol,2-pyrimidinethiol,2-thiopyrimidine,pyrimidine-2 1h-thione,2 1h-pyrimidinethione,pyrimidinethione,2-pyrimidinethione,2-pyrimidinethiol 9ci,2-1h-pyrimidinthione
IUPAC Name	1H-pyrimidine-2-thione
InChI Key	HBCQSNAFLVXVAY-UHFFFAOYSA-N
Molecular Formula	C₄H₄N₂S

1,510

4-Chloro-2,6-dimethylpyrimidine, 97%, Thermo Scientific Chemicals

CAS: 4472-45-1 Molecular Formula: C6H7ClN2 Molecular Weight (g/mol): 142.586 MDL Number: MFCD00234197 InChI Key: GSXFOGXQLRLSKK-UHFFFAOYSA-N PubChem CID: 3154199 IUPAC Name: 4-chloro-2,6-dimethylpyrimidine SMILES: CC1=CC(=NC(=N1)C)Cl

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Specifications

PubChem CID	3154199
CAS	4472-45-1
Molecular Weight (g/mol)	142.586
MDL Number	MFCD00234197
SMILES	CC1=CC(=NC(=N1)C)Cl
IUPAC Name	4-chloro-2,6-dimethylpyrimidine
InChI Key	GSXFOGXQLRLSKK-UHFFFAOYSA-N
Molecular Formula	C6H7ClN2

1,511

2-Amino-4-chloro-7H-pyrrolo[2,3-d]pyrimidine, 97%, Thermo Scientific Chemicals

CAS: 84955-31-7 Molecular Formula: C6H5ClN4 Molecular Weight (g/mol): 168.584 MDL Number: MFCD07369229 InChI Key: VIVLSUIQHWGALQ-UHFFFAOYSA-N Synonym: 4-chloro-7h-pyrrolo 2,3-d pyrimidin-2-amine,2-amino-4-chloropyrrolo 2,3-d pyrimidine,6-chloro-7-deazaguanine,2-amino-4-chloro-7h-pyrrolo 2,3-d pyrimidine,4-chloro-1h-pyrrolo 2,3-d pyrimidin-2-amine,4-chloro-7h-pyrrolo 2,3-d pyrimidin-2-ylamine,1h-pyrrolo 2,3-d pyrimidin-2-amine, 4-chloro,7h-pyrrolo 2,3-d pyrimidin-2-amine, 4-chloro,pubchem17791,6-chloro-7-deazaguamine PubChem CID: 5324413 IUPAC Name: 4-chloro-7H-pyrrolo[2,3-d]pyrimidin-2-amine SMILES: C1=CNC2=C1C(=NC(=N2)N)Cl

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Specifications

PubChem CID	5324413
CAS	84955-31-7
Molecular Weight (g/mol)	168.584
MDL Number	MFCD07369229
SMILES	C1=CNC2=C1C(=NC(=N2)N)Cl
Synonym	4-chloro-7h-pyrrolo 2,3-d pyrimidin-2-amine,2-amino-4-chloropyrrolo 2,3-d pyrimidine,6-chloro-7-deazaguanine,2-amino-4-chloro-7h-pyrrolo 2,3-d pyrimidine,4-chloro-1h-pyrrolo 2,3-d pyrimidin-2-amine,4-chloro-7h-pyrrolo 2,3-d pyrimidin-2-ylamine,1h-pyrrolo 2,3-d pyrimidin-2-amine, 4-chloro,7h-pyrrolo 2,3-d pyrimidin-2-amine, 4-chloro,pubchem17791,6-chloro-7-deazaguamine
IUPAC Name	4-chloro-7H-pyrrolo[2,3-d]pyrimidin-2-amine
InChI Key	VIVLSUIQHWGALQ-UHFFFAOYSA-N
Molecular Formula	C6H5ClN4

1,512

2-(Trifluoromethyl)pyrimidine-5-carboxylic acid, 97%

CAS: 306960-77-0 Molecular Formula: C6H3F3N2O2 Molecular Weight (g/mol): 192.10 MDL Number: MFCD09054851 InChI Key: RGLZXVNOHDUMRJ-UHFFFAOYSA-N Synonym: 2-trifluoromethyl pyrimidine-5-carboxylic acid,2-trifluoromethyl-5-pyrimidinecarboxylic acid,5-pyrimidinecarboxylic acid, 2-trifluoromethyl,5-pyrimidinecarboxylic acid, 2-trifluoromethyl-9ci,pubchem13190,2-trifluoromethylpyrimidine-5-carboxylicacid,2-trifluoromethyl pyrimidine-5-carboxylicacid,2-trifluoromethyl-5-pyrimidinecarboxilic acid,2-trifluoromethyl-pyrimidine-5-carboxylic acid,5-pyrimidinecarboxylicacid, 2-trifluoromethyl PubChem CID: 10583889 IUPAC Name: 2-(trifluoromethyl)pyrimidine-5-carboxylic acid SMILES: OC(=O)C1=CN=C(N=C1)C(F)(F)F

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Specifications

PubChem CID	10583889
CAS	306960-77-0
Molecular Weight (g/mol)	192.10
MDL Number	MFCD09054851
SMILES	OC(=O)C1=CN=C(N=C1)C(F)(F)F
Synonym	2-trifluoromethyl pyrimidine-5-carboxylic acid,2-trifluoromethyl-5-pyrimidinecarboxylic acid,5-pyrimidinecarboxylic acid, 2-trifluoromethyl,5-pyrimidinecarboxylic acid, 2-trifluoromethyl-9ci,pubchem13190,2-trifluoromethylpyrimidine-5-carboxylicacid,2-trifluoromethyl pyrimidine-5-carboxylicacid,2-trifluoromethyl-5-pyrimidinecarboxilic acid,2-trifluoromethyl-pyrimidine-5-carboxylic acid,5-pyrimidinecarboxylicacid, 2-trifluoromethyl
IUPAC Name	2-(trifluoromethyl)pyrimidine-5-carboxylic acid
InChI Key	RGLZXVNOHDUMRJ-UHFFFAOYSA-N
Molecular Formula	C6H3F3N2O2

1,513

2,4-Dihydroxypyrimidine-5-carboxylic acid, 98%

CAS: 23945-44-0 Molecular Formula: C₅H₄N₂O₄ Molecular Weight (g/mol): 156.1 MDL Number: MFCD00149397 InChI Key: ZXYAAVBXHKCJJB-UHFFFAOYSA-N Synonym: 2,4-dihydroxypyrimidine-5-carboxylic acid,uracil 5-carboxylic acid,isoorotic acid,uracil-5-carboxylic acid,5-carboxyuracil,2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylic acid,2,4-dihydroxy-5-pyrimidinecarboxylic acid,5-uracilcarboxylic acid,5-pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-2,4-dioxo,uracil 5-carboxylate PubChem CID: 90301 ChEBI: CHEBI:17477 IUPAC Name: 2,4-dioxo-1H-pyrimidine-5-carboxylic acid SMILES: C1=C(C(=O)NC(=O)N1)C(=O)O

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Specifications

PubChem CID	90301
CAS	23945-44-0
Molecular Weight (g/mol)	156.1
ChEBI	CHEBI:17477
MDL Number	MFCD00149397
SMILES	C1=C(C(=O)NC(=O)N1)C(=O)O
Synonym	2,4-dihydroxypyrimidine-5-carboxylic acid,uracil 5-carboxylic acid,isoorotic acid,uracil-5-carboxylic acid,5-carboxyuracil,2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylic acid,2,4-dihydroxy-5-pyrimidinecarboxylic acid,5-uracilcarboxylic acid,5-pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-2,4-dioxo,uracil 5-carboxylate
IUPAC Name	2,4-dioxo-1H-pyrimidine-5-carboxylic acid
InChI Key	ZXYAAVBXHKCJJB-UHFFFAOYSA-N
Molecular Formula	C₅H₄N₂O₄

1,514

5-Fluoroorotic Acid, MP Biomedicals

CAS: 703-95-7 Molecular Formula: C5H3FN2O4 Molecular Weight (g/mol): 174.087 MDL Number: MFCD00150658 InChI Key: SEHFUALWMUWDKS-UHFFFAOYSA-N Synonym: 5-fluoroorotic acid,5-fluoroorotate,fluoroorotic acid,5-fluoro-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid,orotic acid, 5-fluoro,5-foa,5-fluoro orotic acid,5-fluorouracil-4-carboxylic acid,unii-7ia9ouc93e,5-fluoroorotic acid van PubChem CID: 69711 ChEBI: CHEBI:42535 IUPAC Name: 5-fluoro-2,4-dioxo-1H-pyrimidine-6-carboxylic acid SMILES: C1(=C(NC(=O)NC1=O)C(=O)O)F

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Specifications

PubChem CID	69711
CAS	703-95-7
Molecular Weight (g/mol)	174.087
ChEBI	CHEBI:42535
MDL Number	MFCD00150658
SMILES	C1(=C(NC(=O)NC1=O)C(=O)O)F
Synonym	5-fluoroorotic acid,5-fluoroorotate,fluoroorotic acid,5-fluoro-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid,orotic acid, 5-fluoro,5-foa,5-fluoro orotic acid,5-fluorouracil-4-carboxylic acid,unii-7ia9ouc93e,5-fluoroorotic acid van
IUPAC Name	5-fluoro-2,4-dioxo-1H-pyrimidine-6-carboxylic acid
InChI Key	SEHFUALWMUWDKS-UHFFFAOYSA-N
Molecular Formula	C5H3FN2O4

1,515

Ethyl 4-amino-2-mercaptopyrimidine-5-carboxylate, 97%, Thermo Scientific Chemicals

CAS: 774-07-2 Molecular Formula: C7H9N3O2S Molecular Weight (g/mol): 199.23 MDL Number: MFCD00023227 InChI Key: DKTWKRWWQKVQQB-UHFFFAOYSA-N Synonym: ethyl 4-amino-2-mercaptopyrimidine-5-carboxylate,ethyl 6-amino-2-thioxo-1,2-dihydropyrimidine-5-carboxylate,ethyl 4-amino-2-sulfanylpyrimidine-5-carboxylate,ethyl 4-amino-2-mercapto-5-pyrimidinecarboxylate,ethyl 4-amino-2-mercapropyrimidine-5-carboxylate,5-pyrimidinecarboxylic acid, 4-amino-2-mercapto-, ethyl ester,ethyl 4-amino-2-sulfanyl-5-pyrimidinecarboxylate,ethyl 4-amino-2-sulfanylidene-3h-pyrimidine-5-carboxylate,ethyl 4-amino-2-thioxo-1,2-dihydropyrimidine-5-carboxylate,ethyl 6-amino-2-thioxo-1,2-dihydro-5-pyrimidinecarboxylate PubChem CID: 759149 IUPAC Name: ethyl 6-amino-2-sulfanylidene-1H-pyrimidine-5-carboxylate SMILES: CCOC(=O)C1=C(N)NC(=S)N=C1

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Specifications

PubChem CID	759149
CAS	774-07-2
Molecular Weight (g/mol)	199.23
MDL Number	MFCD00023227
SMILES	CCOC(=O)C1=C(N)NC(=S)N=C1
Synonym	ethyl 4-amino-2-mercaptopyrimidine-5-carboxylate,ethyl 6-amino-2-thioxo-1,2-dihydropyrimidine-5-carboxylate,ethyl 4-amino-2-sulfanylpyrimidine-5-carboxylate,ethyl 4-amino-2-mercapto-5-pyrimidinecarboxylate,ethyl 4-amino-2-mercapropyrimidine-5-carboxylate,5-pyrimidinecarboxylic acid, 4-amino-2-mercapto-, ethyl ester,ethyl 4-amino-2-sulfanyl-5-pyrimidinecarboxylate,ethyl 4-amino-2-sulfanylidene-3h-pyrimidine-5-carboxylate,ethyl 4-amino-2-thioxo-1,2-dihydropyrimidine-5-carboxylate,ethyl 6-amino-2-thioxo-1,2-dihydro-5-pyrimidinecarboxylate
IUPAC Name	ethyl 6-amino-2-sulfanylidene-1H-pyrimidine-5-carboxylate
InChI Key	DKTWKRWWQKVQQB-UHFFFAOYSA-N
Molecular Formula	C7H9N3O2S

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