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Pyrimidines And Derivatives

Aromatic organic compounds that consist of an aromatic six-membered ring containing two non-adjacent nitrogen atoms and four carbon atoms; includes compounds derived from pyrimidines.
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Keyword Search:
1 – 15 of 399 results
1

Uracil, MP Biomedical

CAS: 66-22-8 Molecular Formula: C4H4N2O2 Molecular Weight (g/mol): 112.09 MDL Number: MFCD00006016 InChI Key: ISAKRJDGNUQOIC-UHFFFAOYSA-N Synonym: uracil,2,4-dihydroxypyrimidine,2,4 1h,3h-pyrimidinedione,2,4-pyrimidinediol,pyrimidine-2,4 1h,3h-dione,2,4-dioxopyrimidine,2,4-pyrimidinedione,pirod,pyrod,hybar x PubChem CID: 1174 ChEBI: CHEBI:17568 IUPAC Name: 1,2,3,4-tetrahydropyrimidine-2,4-dione SMILES: O=C1NC=CC(=O)N1

PubChem CID 1174
CAS 66-22-8
Molecular Weight (g/mol) 112.09
ChEBI CHEBI:17568
MDL Number MFCD00006016
SMILES O=C1NC=CC(=O)N1
Synonym uracil,2,4-dihydroxypyrimidine,2,4 1h,3h-pyrimidinedione,2,4-pyrimidinediol,pyrimidine-2,4 1h,3h-dione,2,4-dioxopyrimidine,2,4-pyrimidinedione,pirod,pyrod,hybar x
IUPAC Name 1,2,3,4-tetrahydropyrimidine-2,4-dione
InChI Key ISAKRJDGNUQOIC-UHFFFAOYSA-N
Molecular Formula C4H4N2O2
2

1,5,7-Triazabicyclo[4.4.0]dec-5-ene 98.0+%, TCI America™

CAS: 5807-14-7 Molecular Formula: C7H13N3 Molecular Weight (g/mol): 139.202 MDL Number: MFCD00043003 InChI Key: FVKFHMNJTHKMRX-UHFFFAOYSA-N Synonym: 1,3,4,6,7,8-Hexahydro-2H-pyrimido[1,2-a]pyrimidine, TBD PubChem CID: 79873 IUPAC Name: 3,4,6,7,8,9-hexahydro-2H-pyrimido[1,2-a]pyrimidine SMILES: C1CNC2=NCCCN2C1

PubChem CID 79873
CAS 5807-14-7
Molecular Weight (g/mol) 139.202
MDL Number MFCD00043003
SMILES C1CNC2=NCCCN2C1
Synonym 1,3,4,6,7,8-Hexahydro-2H-pyrimido[1,2-a]pyrimidine, TBD
IUPAC Name 3,4,6,7,8,9-hexahydro-2H-pyrimido[1,2-a]pyrimidine
InChI Key FVKFHMNJTHKMRX-UHFFFAOYSA-N
Molecular Formula C7H13N3
3

Thiamine Hydrochloride Hydrate 98.0+%, TCI America™

CAS: 67-03-8 Molecular Formula: C12H18Cl2N4OS Molecular Weight (g/mol): 337.263 MDL Number: MFCD00012780 InChI Key: DPJRMOMPQZCRJU-UHFFFAOYSA-M Synonym: thiamine hydrochloride,vitamin b1 hydrochloride,thiamine hcl,aneurine hydrochloride,berin,thiamine chloride hydrochloride,trophite,thiamin chloride,thiamine dichloride,thiaminium chloride PubChem CID: 6202 ChEBI: CHEBI:49105 IUPAC Name: 2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol;chloride;hydrochloride SMILES: CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCO.Cl.[Cl-]

PubChem CID 6202
CAS 67-03-8
Molecular Weight (g/mol) 337.263
ChEBI CHEBI:49105
MDL Number MFCD00012780
SMILES CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCO.Cl.[Cl-]
Synonym thiamine hydrochloride,vitamin b1 hydrochloride,thiamine hcl,aneurine hydrochloride,berin,thiamine chloride hydrochloride,trophite,thiamin chloride,thiamine dichloride,thiaminium chloride
IUPAC Name 2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol;chloride;hydrochloride
InChI Key DPJRMOMPQZCRJU-UHFFFAOYSA-M
Molecular Formula C12H18Cl2N4OS
4

Imatinib 98.0+%, TCI America™

CAS: 152459-95-5 Molecular Formula: C29H31N7O Molecular Weight (g/mol): 493.62 MDL Number: MFCD05662257 InChI Key: KTUFNOKKBVMGRW-UHFFFAOYSA-N PubChem CID: 5291 ChEBI: CHEBI:45783 IUPAC Name: N-(4-methyl-3-{[4-(pyridin-3-yl)pyrimidin-2-yl]amino}phenyl)-4-[(4-methylpiperazin-1-yl)methyl]benzamide SMILES: CN1CCN(CC2=CC=C(C=C2)C(=O)NC2=CC=C(C)C(NC3=NC=CC(=N3)C3=CC=CN=C3)=C2)CC1

PubChem CID 5291
CAS 152459-95-5
Molecular Weight (g/mol) 493.62
ChEBI CHEBI:45783
MDL Number MFCD05662257
SMILES CN1CCN(CC2=CC=C(C=C2)C(=O)NC2=CC=C(C)C(NC3=NC=CC(=N3)C3=CC=CN=C3)=C2)CC1
IUPAC Name N-(4-methyl-3-{[4-(pyridin-3-yl)pyrimidin-2-yl]amino}phenyl)-4-[(4-methylpiperazin-1-yl)methyl]benzamide
InChI Key KTUFNOKKBVMGRW-UHFFFAOYSA-N
Molecular Formula C29H31N7O
5

2-Amino-6-chloropurine 98.0+%, TCI America™

CAS: 10310-21-1 Molecular Formula: C5H4ClN5 Molecular Weight (g/mol): 169.57 MDL Number: MFCD00075252 InChI Key: RYYIULNRIVUMTQ-UHFFFAOYSA-N Synonym: 2-amino-6-chloropurine,6-chloroguanine,6-chloro-9h-purin-2-amine,6-chloro-2-aminopurine,2-amino-6-chlorpurine,1h-purin-2-amine, 6-chloro,purine, 2-amino-6-chloro,6-chloro-7h-purin-2-ylamine,2-amino-6-chloro-purin,2-amino-6-chloro-purine PubChem CID: 5360349 ChEBI: CHEBI:72345 IUPAC Name: 6-chloro-7H-purin-2-amine SMILES: NC1=NC(Cl)=C2NC=NC2=N1

PubChem CID 5360349
CAS 10310-21-1
Molecular Weight (g/mol) 169.57
ChEBI CHEBI:72345
MDL Number MFCD00075252
SMILES NC1=NC(Cl)=C2NC=NC2=N1
Synonym 2-amino-6-chloropurine,6-chloroguanine,6-chloro-9h-purin-2-amine,6-chloro-2-aminopurine,2-amino-6-chlorpurine,1h-purin-2-amine, 6-chloro,purine, 2-amino-6-chloro,6-chloro-7h-purin-2-ylamine,2-amino-6-chloro-purin,2-amino-6-chloro-purine
IUPAC Name 6-chloro-7H-purin-2-amine
InChI Key RYYIULNRIVUMTQ-UHFFFAOYSA-N
Molecular Formula C5H4ClN5
6

9-beta-D-Arabinofuranosylguanine Hydrate 98.0+%, TCI America™

CAS: 38819-10-2 Molecular Formula: C10H13N5O5 Molecular Weight (g/mol): 283.24 MDL Number: MFCD00065486 InChI Key: NYHBQMYGNKIUIF-FJFJXFQQSA-N Synonym: Ara-G, Guanine 9-beta-D-Arabinofuranoside PubChem CID: 65412 ChEBI: CHEBI:73141 IUPAC Name: 2-amino-9-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6,9-dihydro-3H-purin-6-one SMILES: NC1=NC(=O)C2=C(N1)N(C=N2)[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O

PubChem CID 65412
CAS 38819-10-2
Molecular Weight (g/mol) 283.24
ChEBI CHEBI:73141
MDL Number MFCD00065486
SMILES NC1=NC(=O)C2=C(N1)N(C=N2)[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O
Synonym Ara-G, Guanine 9-beta-D-Arabinofuranoside
IUPAC Name 2-amino-9-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6,9-dihydro-3H-purin-6-one
InChI Key NYHBQMYGNKIUIF-FJFJXFQQSA-N
Molecular Formula C10H13N5O5
7

5-(Trifluoromethyl)uracil 97.0+%, TCI America™

CAS: 54-20-6 Molecular Formula: C5H3F3N2O2 Molecular Weight (g/mol): 180.09 MDL Number: MFCD00006024 InChI Key: LMNPKIOZMGYQIU-UHFFFAOYSA-N Synonym: 5-trifluoromethyl uracil,5-trifluoromethyluracil,5-trifluoromethyl pyrimidine-2,4 1h,3h-dione,trifluoromethyluracil,2,4 1h,3h-pyrimidinedione, 5-trifluoromethyl,5-tfmu,uracil, 5-trifluoromethyl,5-trifluoromethyl pyrimidine-2,4-diol,5-trifluoromethyl-uracil PubChem CID: 5899 IUPAC Name: 5-(trifluoromethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione SMILES: FC(F)(F)C1=CNC(=O)NC1=O

PubChem CID 5899
CAS 54-20-6
Molecular Weight (g/mol) 180.09
MDL Number MFCD00006024
SMILES FC(F)(F)C1=CNC(=O)NC1=O
Synonym 5-trifluoromethyl uracil,5-trifluoromethyluracil,5-trifluoromethyl pyrimidine-2,4 1h,3h-dione,trifluoromethyluracil,2,4 1h,3h-pyrimidinedione, 5-trifluoromethyl,5-tfmu,uracil, 5-trifluoromethyl,5-trifluoromethyl pyrimidine-2,4-diol,5-trifluoromethyl-uracil
IUPAC Name 5-(trifluoromethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione
InChI Key LMNPKIOZMGYQIU-UHFFFAOYSA-N
Molecular Formula C5H3F3N2O2
8

2-Mercaptopyrimidine 98.0+%, TCI America™

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

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
9

2-(9-Oxoxanthen-2-yl)propionic Acid 1,5,7-Triazabicyclo[4.4.0]dec-5-ene Salt 98.0+%, TCI America™

CAS: 1346753-09-0 Molecular Formula: C23H25N3O4 Molecular Weight (g/mol): 407.47 InChI Key: NHCZYSDZAMNWGB-UHFFFAOYSA-N PubChem CID: 91972053 IUPAC Name: 1,2,3,4,6,7,8,9-octahydropyrimido[1,2-a]pyrimidin-5-ium;2-(9-oxoxanthen-2-yl)propanoate SMILES: CC(C1=CC2=C(C=C1)OC3=CC=CC=C3C2=O)C(=O)[O-].C1CNC2=[N+](C1)CCCN2

PubChem CID 91972053
CAS 1346753-09-0
Molecular Weight (g/mol) 407.47
SMILES CC(C1=CC2=C(C=C1)OC3=CC=CC=C3C2=O)C(=O)[O-].C1CNC2=[N+](C1)CCCN2
IUPAC Name 1,2,3,4,6,7,8,9-octahydropyrimido[1,2-a]pyrimidin-5-ium;2-(9-oxoxanthen-2-yl)propanoate
InChI Key NHCZYSDZAMNWGB-UHFFFAOYSA-N
Molecular Formula C23H25N3O4
10

Imatinib Mesylate 98.0+%, TCI America™

CAS: 220127-57-1 Molecular Formula: C30H35N7O4S Molecular Weight (g/mol): 589.72 MDL Number: MFCD04307699 InChI Key: YLMAHDNUQAMNNX-UHFFFAOYSA-N Synonym: imatinib mesylate,gleevec,glivec,imatinib mesilate,imatinib methanesulfonate,imatinib mesylate sti571,imatinib monomesylate,unii-8a1o1m485b,imatinib, methanesulfonate salt PubChem CID: 123596 ChEBI: CHEBI:31690 IUPAC Name: N-(4-methyl-3-{[4-(pyridin-3-yl)pyrimidin-2-yl]amino}phenyl)-4-[(4-methylpiperazin-1-yl)methyl]benzamide; methanesulfonic acid SMILES: CS(O)(=O)=O.CN1CCN(CC2=CC=C(C=C2)C(=O)NC2=CC=C(C)C(NC3=NC=CC(=N3)C3=CC=CN=C3)=C2)CC1

PubChem CID 123596
CAS 220127-57-1
Molecular Weight (g/mol) 589.72
ChEBI CHEBI:31690
MDL Number MFCD04307699
SMILES CS(O)(=O)=O.CN1CCN(CC2=CC=C(C=C2)C(=O)NC2=CC=C(C)C(NC3=NC=CC(=N3)C3=CC=CN=C3)=C2)CC1
Synonym imatinib mesylate,gleevec,glivec,imatinib mesilate,imatinib methanesulfonate,imatinib mesylate sti571,imatinib monomesylate,unii-8a1o1m485b,imatinib, methanesulfonate salt
IUPAC Name N-(4-methyl-3-{[4-(pyridin-3-yl)pyrimidin-2-yl]amino}phenyl)-4-[(4-methylpiperazin-1-yl)methyl]benzamide; methanesulfonic acid
InChI Key YLMAHDNUQAMNNX-UHFFFAOYSA-N
Molecular Formula C30H35N7O4S
11

2-Amino-4,6-dihydroxypyrimidine 98.0+%, TCI America™

CAS: 56-09-7 Molecular Formula: C4H5N3O2 Molecular Weight (g/mol): 127.10 MDL Number: MFCD00006094 InChI Key: AUFJTVGCSJNQIF-UHFFFAOYSA-N Synonym: 2-amino-4,6-dihydroxypyrimidine,2-aminopyrimidine-4,6-diol,4 1h-pyrimidinone, 2-amino-6-hydroxy,2-amino-6-hydroxypyrimidin-4 3h-one,2-amino-4,6-dioxypyrimidine,2-amino-4,6-pyrimidinedione,4,6-dihydroxy-2-aminopyrimidine,2-amino-4,6-pyrimidinediol,2-amino-6-hydroxy-1h-pyrimidin-4-one,2-amino-6-hydroxy-4 1h-pyrimidinone PubChem CID: 66131 IUPAC Name: 2-amino-6-hydroxy-3,4-dihydropyrimidin-4-one SMILES: NC1=NC(O)=CC(=O)N1

PubChem CID 66131
CAS 56-09-7
Molecular Weight (g/mol) 127.10
MDL Number MFCD00006094
SMILES NC1=NC(O)=CC(=O)N1
Synonym 2-amino-4,6-dihydroxypyrimidine,2-aminopyrimidine-4,6-diol,4 1h-pyrimidinone, 2-amino-6-hydroxy,2-amino-6-hydroxypyrimidin-4 3h-one,2-amino-4,6-dioxypyrimidine,2-amino-4,6-pyrimidinedione,4,6-dihydroxy-2-aminopyrimidine,2-amino-4,6-pyrimidinediol,2-amino-6-hydroxy-1h-pyrimidin-4-one,2-amino-6-hydroxy-4 1h-pyrimidinone
IUPAC Name 2-amino-6-hydroxy-3,4-dihydropyrimidin-4-one
InChI Key AUFJTVGCSJNQIF-UHFFFAOYSA-N
Molecular Formula C4H5N3O2
12

5-Aminouracil 98.0+%, TCI America™

CAS: 932-52-5 Molecular Formula: C4H5N3O2 Molecular Weight (g/mol): 127.10 MDL Number: MFCD00006025 InChI Key: BISHACNKZIBDFM-UHFFFAOYSA-N Synonym: 5-aminouracil,5-amino-2,4-dihydroxypyrimidine,uracil, 5-amino,2,4 1h,3h-pyrimidinedione, 5-amino,2,4-dihydroxy-5-aminopyrimidine,unii-r2o7eky9g9,r2o7eky9g9,5-aminopyrimidine-2,4-diol,5-amino-1,3-dihydropyrimidine-2,4-dione,wbu PubChem CID: 13611 ChEBI: CHEBI:46348 IUPAC Name: 5-amino-1,2,3,4-tetrahydropyrimidine-2,4-dione SMILES: NC1=CNC(=O)NC1=O

PubChem CID 13611
CAS 932-52-5
Molecular Weight (g/mol) 127.10
ChEBI CHEBI:46348
MDL Number MFCD00006025
SMILES NC1=CNC(=O)NC1=O
Synonym 5-aminouracil,5-amino-2,4-dihydroxypyrimidine,uracil, 5-amino,2,4 1h,3h-pyrimidinedione, 5-amino,2,4-dihydroxy-5-aminopyrimidine,unii-r2o7eky9g9,r2o7eky9g9,5-aminopyrimidine-2,4-diol,5-amino-1,3-dihydropyrimidine-2,4-dione,wbu
IUPAC Name 5-amino-1,2,3,4-tetrahydropyrimidine-2,4-dione
InChI Key BISHACNKZIBDFM-UHFFFAOYSA-N
Molecular Formula C4H5N3O2
13

5,6-Diamino-1,3-dipropyluracil Hydrochloride 98.0+%, TCI America™

CAS: 324002-49-5 Molecular Formula: C10H19ClN4O2 Molecular Weight (g/mol): 262.738 MDL Number: MFCD06797515 InChI Key: DWPGKJBUHDOVAD-UHFFFAOYSA-N PubChem CID: 18767618 IUPAC Name: 5,6-diamino-1,3-dipropylpyrimidine-2,4-dione;hydrochloride SMILES: CCCN1C(=C(C(=O)N(C1=O)CCC)N)N.Cl

PubChem CID 18767618
CAS 324002-49-5
Molecular Weight (g/mol) 262.738
MDL Number MFCD06797515
SMILES CCCN1C(=C(C(=O)N(C1=O)CCC)N)N.Cl
IUPAC Name 5,6-diamino-1,3-dipropylpyrimidine-2,4-dione;hydrochloride
InChI Key DWPGKJBUHDOVAD-UHFFFAOYSA-N
Molecular Formula C10H19ClN4O2
14

6-Phenylisocytosine 98.0+%, TCI America™

CAS: 56741-94-7 Molecular Formula: C10H9N3O Molecular Weight (g/mol): 187.202 MDL Number: MFCD00466412 InChI Key: KXYGHDWFGFZJPJ-UHFFFAOYSA-N Synonym: 2-Amino-6-phenyl-4(1H)-pyrimidinone PubChem CID: 95891 IUPAC Name: 2-amino-6-phenyl-1H-pyrimidin-4-one SMILES: C1=CC=C(C=C1)C2=CC(=O)N=C(N2)N

PubChem CID 95891
CAS 56741-94-7
Molecular Weight (g/mol) 187.202
MDL Number MFCD00466412
SMILES C1=CC=C(C=C1)C2=CC(=O)N=C(N2)N
Synonym 2-Amino-6-phenyl-4(1H)-pyrimidinone
IUPAC Name 2-amino-6-phenyl-1H-pyrimidin-4-one
InChI Key KXYGHDWFGFZJPJ-UHFFFAOYSA-N
Molecular Formula C10H9N3O
15

5-Bromouridine 99.0+%, TCI America™

CAS: 957-75-5 Molecular Formula: C9H11BrN2O6 Molecular Weight (g/mol): 323.10 MDL Number: MFCD00006528 InChI Key: AGFIRQJZCNVMCW-UHFFFAOYNA-N Synonym: 5-bromouridine,uridine, 5-bromo,1-beta-ribofuranosyl-5-bromo-uracil,5-bromo-1-2r,3r,4s,5r-3,4-dihydroxy-5-hydroxymethyl tetrahydrofuran-2-yl pyrimidine-2,4 1h,3h-dione,bromouridine,5-bromo-uridine,key8pg1brc,unii-key8pg1brc,5-bromouracil ribonucleoside,bru PubChem CID: 91494 ChEBI: CHEBI:20553 IUPAC Name: 5-bromo-1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2,3,4-tetrahydropyrimidine-2,4-dione SMILES: OCC1OC(C(O)C1O)N1C=C(Br)C(=O)NC1=O

PubChem CID 91494
CAS 957-75-5
Molecular Weight (g/mol) 323.10
ChEBI CHEBI:20553
MDL Number MFCD00006528
SMILES OCC1OC(C(O)C1O)N1C=C(Br)C(=O)NC1=O
Synonym 5-bromouridine,uridine, 5-bromo,1-beta-ribofuranosyl-5-bromo-uracil,5-bromo-1-2r,3r,4s,5r-3,4-dihydroxy-5-hydroxymethyl tetrahydrofuran-2-yl pyrimidine-2,4 1h,3h-dione,bromouridine,5-bromo-uridine,key8pg1brc,unii-key8pg1brc,5-bromouracil ribonucleoside,bru
IUPAC Name 5-bromo-1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2,3,4-tetrahydropyrimidine-2,4-dione
InChI Key AGFIRQJZCNVMCW-UHFFFAOYNA-N
Molecular Formula C9H11BrN2O6