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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1,006 – 1,020 of 195,531 results

1,006

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

1,007

Thermo Scientific™ 2,5-Dihydro-2,5-dimethoxyfuran, cis + trans, 99%

CAS: 332-77-4 Molecular Formula: C6H10O3 Molecular Weight (g/mol): 130.14 MDL Number: MFCD00003220 InChI Key: WXFWXFIWDGJRSC-UHFFFAOYNA-N Synonym: 2,5-Dimethoxy-2,5-dihydrofuran; IUPAC Name: 2,5-dimethoxy-2,5-dihydrofuran SMILES: COC1OC(OC)C=C1

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CAS	332-77-4
Molecular Weight (g/mol)	130.14
MDL Number	MFCD00003220
SMILES	COC1OC(OC)C=C1
Synonym	2,5-Dimethoxy-2,5-dihydrofuran;
IUPAC Name	2,5-dimethoxy-2,5-dihydrofuran
InChI Key	WXFWXFIWDGJRSC-UHFFFAOYNA-N
Molecular Formula	C6H10O3

1,008

4-chloro-5-(2-thienyl)thieno[2,3-d]pyrimidine, 97%, Thermo Scientific™

CAS: 189681-04-7 Molecular Formula: C10H5ClN2S2 Molecular Weight (g/mol): 252.73 MDL Number: MFCD00174019 InChI Key: VNWBUFWVNCUUKY-UHFFFAOYSA-N Synonym: 4-chloro-5-2-thienyl thieno 2,3-d pyrimidine,4-chloro-5-thiophen-2-yl thieno 2,3-d pyrimidine,thieno 2,3-d pyrimidine,4-chloro-5-2-thienyl,4-chloro-5-2-thienyl thiopheno 2,3-d pyrimidine,4-chloro-5-thiophen-2-ylthieno 2,3-d pyrimidine PubChem CID: 735732 SMILES: ClC1=C2C(SC=C2C2=CC=CS2)=NC=N1

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Specifications

PubChem CID	735732
CAS	189681-04-7
Molecular Weight (g/mol)	252.73
MDL Number	MFCD00174019
SMILES	ClC1=C2C(SC=C2C2=CC=CS2)=NC=N1
Synonym	4-chloro-5-2-thienyl thieno 2,3-d pyrimidine,4-chloro-5-thiophen-2-yl thieno 2,3-d pyrimidine,thieno 2,3-d pyrimidine,4-chloro-5-2-thienyl,4-chloro-5-2-thienyl thiopheno 2,3-d pyrimidine,4-chloro-5-thiophen-2-ylthieno 2,3-d pyrimidine
InChI Key	VNWBUFWVNCUUKY-UHFFFAOYSA-N
Molecular Formula	C10H5ClN2S2

1,009

2,2':6',2″-Terpyridine, 97%

CAS: 1148-79-4 Molecular Formula: C15H11N3 Molecular Weight (g/mol): 233.27 MDL Number: MFCD00006213 InChI Key: DRGAZIDRYFYHIJ-UHFFFAOYSA-N Synonym: 2,2':6',2-terpyridine,tripyridyl,tripyridine,2,6-bis 2-pyridyl pyridine,terpy,terpyridine,2,2',2-terpyridine,2,2',2-terpyridyl,2,2',2-tripyridyl,2,2',2-tripyridine PubChem CID: 70848 ChEBI: CHEBI:245199 IUPAC Name: 2,6-dipyridin-2-ylpyridine SMILES: C1=CC=C(N=C1)C1=CC=CC(=N1)C1=CC=CC=N1

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Specifications

PubChem CID	70848
CAS	1148-79-4
Molecular Weight (g/mol)	233.27
ChEBI	CHEBI:245199
MDL Number	MFCD00006213
SMILES	C1=CC=C(N=C1)C1=CC=CC(=N1)C1=CC=CC=N1
Synonym	2,2':6',2-terpyridine,tripyridyl,tripyridine,2,6-bis 2-pyridyl pyridine,terpy,terpyridine,2,2',2-terpyridine,2,2',2-terpyridyl,2,2',2-tripyridyl,2,2',2-tripyridine
IUPAC Name	2,6-dipyridin-2-ylpyridine
InChI Key	DRGAZIDRYFYHIJ-UHFFFAOYSA-N
Molecular Formula	C15H11N3

1,010

3-Amino-5-bromo-1H-indazole, 95%

CAS: 61272-71-7 Molecular Formula: C7H6BrN3 Molecular Weight (g/mol): 212.05 MDL Number: MFCD03426696 InChI Key: OMPYFDJVSAMSMA-UHFFFAOYSA-N Synonym: 3-amino-5-bromo-1h-indazole,3-amino-5-bromoindazole,5-bromo-1h-indazol-3-ylamine,1h-indazol-3-amine, 5-bromo,5-bromo-1h-indazole-3-ylamine,pubchem18573,3-amino-5-bromo-indazole,acmc-1b3h9,5-bromo-1h-indazole-3-amine PubChem CID: 817910 IUPAC Name: 5-bromo-1H-indazol-3-amine SMILES: NC1=NNC2=CC=C(Br)C=C12

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Specifications

PubChem CID	817910
CAS	61272-71-7
Molecular Weight (g/mol)	212.05
MDL Number	MFCD03426696
SMILES	NC1=NNC2=CC=C(Br)C=C12
Synonym	3-amino-5-bromo-1h-indazole,3-amino-5-bromoindazole,5-bromo-1h-indazol-3-ylamine,1h-indazol-3-amine, 5-bromo,5-bromo-1h-indazole-3-ylamine,pubchem18573,3-amino-5-bromo-indazole,acmc-1b3h9,5-bromo-1h-indazole-3-amine
IUPAC Name	5-bromo-1H-indazol-3-amine
InChI Key	OMPYFDJVSAMSMA-UHFFFAOYSA-N
Molecular Formula	C7H6BrN3

1,011

3-Cyanopyridine 1-oxide, 97%

CAS: 14906-64-0 Molecular Formula: C6H5N2O Molecular Weight (g/mol): 121.12 MDL Number: MFCD00129037 InChI Key: AABSWFBNBQBPEQ-UHFFFAOYNA-N Synonym: nicotinonitrile-1-oxide,3-cyanopyridine n-oxide,3-cyanopyridine-n-oxide,nicotinonitrile 1-oxide,3-cyanopyridine 1-oxide,3-cyanopyridin-1-ium-1-olate,3-pyridinecarbonitrile, 1-oxide,acmc-1c6hr,3-pyridinecarbonitrile,1-oxide,woovsqcalyyudo-uhfffaoysa PubChem CID: 84686 SMILES: [O-][NH++]1C=C[CH-]C(=C1)C#N

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Specifications

PubChem CID	84686
CAS	14906-64-0
Molecular Weight (g/mol)	121.12
MDL Number	MFCD00129037
SMILES	[O-][NH++]1C=C[CH-]C(=C1)C#N
Synonym	nicotinonitrile-1-oxide,3-cyanopyridine n-oxide,3-cyanopyridine-n-oxide,nicotinonitrile 1-oxide,3-cyanopyridine 1-oxide,3-cyanopyridin-1-ium-1-olate,3-pyridinecarbonitrile, 1-oxide,acmc-1c6hr,3-pyridinecarbonitrile,1-oxide,woovsqcalyyudo-uhfffaoysa
InChI Key	AABSWFBNBQBPEQ-UHFFFAOYNA-N
Molecular Formula	C6H5N2O

1,012

4,5,6,7-Tetrahydro-benzo[c]thiophene-1-carboxylic acid, 97%, Thermo Scientific™

CAS: 6435-75-2 Molecular Formula: C9H10O2S Molecular Weight (g/mol): 182.24 MDL Number: MFCD03086149 InChI Key: ZBNTUDLPJCXPNF-UHFFFAOYSA-N Synonym: 4,5,6,7-tetrahydrobenzo c thiophene-1-carboxylic acid,4,5,6,7-tetrahydro-benzo c thiophene-1-carboxylic acid,1-carboxy-4,5,6,7-tetrahydrobenzo c thiophene,4,5,6,7-tetrahydrobenzo 2,1-c thiophenecarboxylic acid,benzo c thiophene-1-carboxylicacid, 4,5,6,7-tetrahydro,4,5,6,7-tetrahydro-2-benzo b thiophene-1-carboxylic acid PubChem CID: 299400 IUPAC Name: 4,5,6,7-tetrahydro-2-benzothiophene-1-carboxylic acid SMILES: OC(=O)C1=C2CCCCC2=CS1

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Specifications

PubChem CID	299400
CAS	6435-75-2
Molecular Weight (g/mol)	182.24
MDL Number	MFCD03086149
SMILES	OC(=O)C1=C2CCCCC2=CS1
Synonym	4,5,6,7-tetrahydrobenzo c thiophene-1-carboxylic acid,4,5,6,7-tetrahydro-benzo c thiophene-1-carboxylic acid,1-carboxy-4,5,6,7-tetrahydrobenzo c thiophene,4,5,6,7-tetrahydrobenzo 2,1-c thiophenecarboxylic acid,benzo c thiophene-1-carboxylicacid, 4,5,6,7-tetrahydro,4,5,6,7-tetrahydro-2-benzo b thiophene-1-carboxylic acid
IUPAC Name	4,5,6,7-tetrahydro-2-benzothiophene-1-carboxylic acid
InChI Key	ZBNTUDLPJCXPNF-UHFFFAOYSA-N
Molecular Formula	C9H10O2S

1,013

2-Amino-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile

CAS: 70291-62-2 Molecular Formula: C8H8N2S Molecular Weight (g/mol): 164.23 MDL Number: MFCD00121495 InChI Key: RILAXFOADRDGPQ-UHFFFAOYSA-N PubChem CID: 258182 IUPAC Name: 2-amino-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile SMILES: NC1=C(C#N)C2=C(CCC2)S1

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Specifications

PubChem CID	258182
CAS	70291-62-2
Molecular Weight (g/mol)	164.23
MDL Number	MFCD00121495
SMILES	NC1=C(C#N)C2=C(CCC2)S1
IUPAC Name	2-amino-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile
InChI Key	RILAXFOADRDGPQ-UHFFFAOYSA-N
Molecular Formula	C8H8N2S

1,014

6-Bromo-3,4-dihydro-2H-1,4-benzothiazine, 97%

CAS: 187604-75-7 Molecular Formula: C8H8BrNS Molecular Weight (g/mol): 230.123 MDL Number: MFCD23379863 InChI Key: AUIBYERXYVUBIL-UHFFFAOYSA-N Synonym: 6-bromo-3,4-dihydro-2h-benzo b 1,4 thiazine PubChem CID: 67172430 IUPAC Name: 6-bromo-3,4-dihydro-2H-1,4-benzothiazine SMILES: C1CSC2=C(N1)C=C(C=C2)Br

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Specifications

PubChem CID	67172430
CAS	187604-75-7
Molecular Weight (g/mol)	230.123
MDL Number	MFCD23379863
SMILES	C1CSC2=C(N1)C=C(C=C2)Br
Synonym	6-bromo-3,4-dihydro-2h-benzo b 1,4 thiazine
IUPAC Name	6-bromo-3,4-dihydro-2H-1,4-benzothiazine
InChI Key	AUIBYERXYVUBIL-UHFFFAOYSA-N
Molecular Formula	C8H8BrNS

1,015

1H-Indazole-6-carboxylic acid, 97%

CAS: 704-91-6 Molecular Formula: C8H6N2O2 Molecular Weight (g/mol): 162.15 MDL Number: MFCD06804571 InChI Key: DNCVTVVLMRHJCJ-UHFFFAOYSA-N Synonym: indazole-6-carboxylic acid,1h-indazole-6-carboxylicacid,6-carboxyindazole,6-carboxy-1h-indazole,6-indazolecarboxylic acid,ksc376q7p,1h-indazole-6-carboxylic acid,6-1h indazole carboxylic acid PubChem CID: 16227938 IUPAC Name: 1H-indazole-6-carboxylic acid SMILES: OC(=O)C1=CC=C2C=NNC2=C1

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Specifications

PubChem CID	16227938
CAS	704-91-6
Molecular Weight (g/mol)	162.15
MDL Number	MFCD06804571
SMILES	OC(=O)C1=CC=C2C=NNC2=C1
Synonym	indazole-6-carboxylic acid,1h-indazole-6-carboxylicacid,6-carboxyindazole,6-carboxy-1h-indazole,6-indazolecarboxylic acid,ksc376q7p,1h-indazole-6-carboxylic acid,6-1h indazole carboxylic acid
IUPAC Name	1H-indazole-6-carboxylic acid
InChI Key	DNCVTVVLMRHJCJ-UHFFFAOYSA-N
Molecular Formula	C8H6N2O2

1,016

Thermo Scientific Chemicals Diacetone-D-glucose, 98+%

CAS: 582-52-5 Molecular Formula: C₁₂H₂₀O₆ Molecular Weight (g/mol): 260.28 MDL Number: MFCD00005544 InChI Key: KEJGAYKWRDILTF-MQIGXGKASA-N Synonym: 1,2:5,6-diisopropylidene-d-glucose,1,2:5,6-di-o-isopropylidene-alpha-d-glucofuranose,3ar,5r,6s,6as-5-4s-2,2-dimethyl-1,3-dioxolan-4-yl-2,2-dimethyl-tetrahydrofuro 2,3-d 1,3 dioxol-6-ol PubChem CID: 40469256 IUPAC Name: (3aR,5S,6S,6aS)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-ol SMILES: CC1(OCC(O1)C2C(C3C(O2)OC(O3)(C)C)O)C

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Specifications

PubChem CID	40469256
CAS	582-52-5
Molecular Weight (g/mol)	260.28
MDL Number	MFCD00005544
SMILES	CC1(OCC(O1)C2C(C3C(O2)OC(O3)(C)C)O)C
Synonym	1,2:5,6-diisopropylidene-d-glucose,1,2:5,6-di-o-isopropylidene-alpha-d-glucofuranose,3ar,5r,6s,6as-5-4s-2,2-dimethyl-1,3-dioxolan-4-yl-2,2-dimethyl-tetrahydrofuro 2,3-d 1,3 dioxol-6-ol
IUPAC Name	(3aR,5S,6S,6aS)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-ol
InChI Key	KEJGAYKWRDILTF-MQIGXGKASA-N
Molecular Formula	C₁₂H₂₀O₆

1,017

2,3-Diphenylquinoxaline, 98+%

CAS: 1684-14-6 Molecular Formula: C20H14N2 Molecular Weight (g/mol): 282.346 MDL Number: MFCD00014659 InChI Key: RSNQVABHABAKEZ-UHFFFAOYSA-N PubChem CID: 74311 IUPAC Name: 2,3-diphenylquinoxaline SMILES: C1=CC=C(C=C1)C2=NC3=CC=CC=C3N=C2C4=CC=CC=C4

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Specifications

PubChem CID	74311
CAS	1684-14-6
Molecular Weight (g/mol)	282.346
MDL Number	MFCD00014659
SMILES	C1=CC=C(C=C1)C2=NC3=CC=CC=C3N=C2C4=CC=CC=C4
IUPAC Name	2,3-diphenylquinoxaline
InChI Key	RSNQVABHABAKEZ-UHFFFAOYSA-N
Molecular Formula	C20H14N2

1,018

1-Methyl-3-n-propylimidazolium iodide, 98%

CAS: 119171-18-5 Molecular Formula: C7H13IN2 Molecular Weight (g/mol): 252.10 MDL Number: MFCD08276385 InChI Key: IVCMUVGRRDWTDK-UHFFFAOYSA-M Synonym: 1-methyl-3-propylimidazolium iodide,1-propyl-3-methylimidazolium iodide,1-methyl-3-n-propylimidazolium iodide,1-methyl-3-propylimidazol-1-ium iodide,acmc-1c1fw,dsstox_cid_29063,dsstox_rid_83282,dsstox_gsid_49207,ksc491c6t,1-methyl-3-propylimidazoliumiodide PubChem CID: 12971008 IUPAC Name: 1-methyl-3-propylimidazol-1-ium;iodide SMILES: [I-].CCCN1C=C[N+](C)=C1

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Specifications

PubChem CID	12971008
CAS	119171-18-5
Molecular Weight (g/mol)	252.10
MDL Number	MFCD08276385
SMILES	[I-].CCCN1C=C[N+](C)=C1
Synonym	1-methyl-3-propylimidazolium iodide,1-propyl-3-methylimidazolium iodide,1-methyl-3-n-propylimidazolium iodide,1-methyl-3-propylimidazol-1-ium iodide,acmc-1c1fw,dsstox_cid_29063,dsstox_rid_83282,dsstox_gsid_49207,ksc491c6t,1-methyl-3-propylimidazoliumiodide
IUPAC Name	1-methyl-3-propylimidazol-1-ium;iodide
InChI Key	IVCMUVGRRDWTDK-UHFFFAOYSA-M
Molecular Formula	C7H13IN2

1,019

Isonipecotamide, 98%

CAS: 39546-32-2 Molecular Formula: C6H12N2O Molecular Weight (g/mol): 128.18 MDL Number: MFCD00038012 InChI Key: DPBWFNDFMCCGGJ-UHFFFAOYSA-N Synonym: isonipecotamide,4-piperidinecarboxamide,hexahydroisonicotinamide,4-carbamoylpiperidine,isonipectoamide,piperidine-4-carboxylic acid amide,4-piperdinecarboxamide,piperidin-4-carboxamid,iso nipecotamide,iso-nipecotamide PubChem CID: 3772 IUPAC Name: piperidine-4-carboxamide SMILES: NC(=O)C1CCNCC1

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Specifications

PubChem CID	3772
CAS	39546-32-2
Molecular Weight (g/mol)	128.18
MDL Number	MFCD00038012
SMILES	NC(=O)C1CCNCC1
Synonym	isonipecotamide,4-piperidinecarboxamide,hexahydroisonicotinamide,4-carbamoylpiperidine,isonipectoamide,piperidine-4-carboxylic acid amide,4-piperdinecarboxamide,piperidin-4-carboxamid,iso nipecotamide,iso-nipecotamide
IUPAC Name	piperidine-4-carboxamide
InChI Key	DPBWFNDFMCCGGJ-UHFFFAOYSA-N
Molecular Formula	C6H12N2O

1,020

(4-Pyrid-3-ylphenyl)methanol, ≥97%, Thermo Scientific™

CAS: 217189-04-3 Molecular Formula: C12H11NO Molecular Weight (g/mol): 185.226 MDL Number: MFCD04116293 InChI Key: ZHIJCVCCKVZBHE-UHFFFAOYSA-N Synonym: 4-pyrid-3-ylphenyl methanol,4-pyridin-3-yl phenyl methanol,4-pyridin-3-ylphenyl methanol,benzenemethanol,4-3-pyridinyl,4-pyridin-3-yl-phenyl-methanol,4-3-pyridyl-phenyl-methanol,4-3-pyridyl phenyl methan-1-ol,3-4-hydroxymethyl phenyl pyridine,3-4-hydroxymethylphenyl pyridine PubChem CID: 1515243 IUPAC Name: (4-pyridin-3-ylphenyl)methanol SMILES: C1=CC(=CN=C1)C2=CC=C(C=C2)CO

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Specifications

PubChem CID	1515243
CAS	217189-04-3
Molecular Weight (g/mol)	185.226
MDL Number	MFCD04116293
SMILES	C1=CC(=CN=C1)C2=CC=C(C=C2)CO
Synonym	4-pyrid-3-ylphenyl methanol,4-pyridin-3-yl phenyl methanol,4-pyridin-3-ylphenyl methanol,benzenemethanol,4-3-pyridinyl,4-pyridin-3-yl-phenyl-methanol,4-3-pyridyl-phenyl-methanol,4-3-pyridyl phenyl methan-1-ol,3-4-hydroxymethyl phenyl pyridine,3-4-hydroxymethylphenyl pyridine
IUPAC Name	(4-pyridin-3-ylphenyl)methanol
InChI Key	ZHIJCVCCKVZBHE-UHFFFAOYSA-N
Molecular Formula	C12H11NO

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