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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2-Hydroxypyrimidine hydrochloride, 98%

CAS: 38353-09-2 Molecular Formula: C₄H₄N₂O·ClH Molecular Weight (g/mol): 132.55 MDL Number: MFCD00012781 InChI Key: IAJINJSFYTZPEJ-UHFFFAOYSA-N Synonym: 2-hydroxypyrimidine hydrochloride,pyrimidin-2-ol hydrochloride,2 1h-pyrimidinone, monohydrochloride,2-hydroxypyrimidine hcl,2-pyrimidinone hydrochloride,pyrimidin-2 1h-one hydrochloride,2-hydroxypyrimidinehydrochloride,pyrimidin-2-one monohydrochloride,1,2-dihydropyrimidin-2-one hydrochloride,pyrimidin-2-one hydrochloride PubChem CID: 122774 IUPAC Name: 1H-pyrimidin-2-one;hydrochloride SMILES: C1=CNC(=O)N=C1.Cl

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Specifications

PubChem CID	122774
CAS	38353-09-2
Molecular Weight (g/mol)	132.55
MDL Number	MFCD00012781
SMILES	C1=CNC(=O)N=C1.Cl
Synonym	2-hydroxypyrimidine hydrochloride,pyrimidin-2-ol hydrochloride,2 1h-pyrimidinone, monohydrochloride,2-hydroxypyrimidine hcl,2-pyrimidinone hydrochloride,pyrimidin-2 1h-one hydrochloride,2-hydroxypyrimidinehydrochloride,pyrimidin-2-one monohydrochloride,1,2-dihydropyrimidin-2-one hydrochloride,pyrimidin-2-one hydrochloride
IUPAC Name	1H-pyrimidin-2-one;hydrochloride
InChI Key	IAJINJSFYTZPEJ-UHFFFAOYSA-N
Molecular Formula	C₄H₄N₂O·ClH

Thermo Scientific Chemicals 5-Iodouracil, 99%

CAS: 696-07-1 Molecular Formula: C4H3IN2O2 Molecular Weight (g/mol): 237.98 MDL Number: MFCD00006020 InChI Key: KSNXJLQDQOIRIP-UHFFFAOYSA-N Synonym: 5-iodouracil,5-iodopyrimidine-2,4 1h,3h-dione,2,4 1h,3h-pyrimidinedione, 5-iodo,uracil, 5-iodo,5-iodopyrimidine-2,4-diol,2,4-dihydroxy-5-iodopyrimidine,5-iodo uracil,unii-h59brk500m,chembl1173,5-iodo-1,2,3,4-tetrahydropyrimidine-2,4-dione PubChem CID: 69672 ChEBI: CHEBI:43636 IUPAC Name: 5-iodo-1H-pyrimidine-2,4-dione SMILES: IC1=CNC(=O)NC1=O

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Specifications

PubChem CID	69672
CAS	696-07-1
Molecular Weight (g/mol)	237.98
ChEBI	CHEBI:43636
MDL Number	MFCD00006020
SMILES	IC1=CNC(=O)NC1=O
Synonym	5-iodouracil,5-iodopyrimidine-2,4 1h,3h-dione,2,4 1h,3h-pyrimidinedione, 5-iodo,uracil, 5-iodo,5-iodopyrimidine-2,4-diol,2,4-dihydroxy-5-iodopyrimidine,5-iodo uracil,unii-h59brk500m,chembl1173,5-iodo-1,2,3,4-tetrahydropyrimidine-2,4-dione
IUPAC Name	5-iodo-1H-pyrimidine-2,4-dione
InChI Key	KSNXJLQDQOIRIP-UHFFFAOYSA-N
Molecular Formula	C4H3IN2O2

Thermo Scientific Chemicals Imatinib mesylate, 98%

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: methanesulfonic acid;4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide 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

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Specifications

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	methanesulfonic acid;4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide
InChI Key	YLMAHDNUQAMNNX-UHFFFAOYSA-N
Molecular Formula	C30H35N7O4S

4,5,6-Trifluoropyrimidine, 97%, Thermo Scientific Chemicals

CAS: 17573-78-3 Molecular Formula: C4HF3N2 Molecular Weight (g/mol): 134.06 MDL Number: MFCD05662363 InChI Key: AQKOJKCYBNUFLU-UHFFFAOYSA-N Synonym: pyrimidine, 4,5,6-trifluoro,pubchem6922,acmc-1bol2,pyrimidine,4,5,6-trifluoro,4,5,6-trifluoro-1,3-diazine,4,5,6-tris fluoranyl pyrimidine,4,5,6-trifluoropyrimidine,4,5,6-trifluoro pyrimidine,pyrimidine, 4,5,6-trifluoro-8ci,9ci PubChem CID: 3572764 IUPAC Name: 4,5,6-trifluoropyrimidine SMILES: FC1=NC=NC(F)=C1F

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Specifications

PubChem CID	3572764
CAS	17573-78-3
Molecular Weight (g/mol)	134.06
MDL Number	MFCD05662363
SMILES	FC1=NC=NC(F)=C1F
Synonym	pyrimidine, 4,5,6-trifluoro,pubchem6922,acmc-1bol2,pyrimidine,4,5,6-trifluoro,4,5,6-trifluoro-1,3-diazine,4,5,6-tris fluoranyl pyrimidine,4,5,6-trifluoropyrimidine,4,5,6-trifluoro pyrimidine,pyrimidine, 4,5,6-trifluoro-8ci,9ci
IUPAC Name	4,5,6-trifluoropyrimidine
InChI Key	AQKOJKCYBNUFLU-UHFFFAOYSA-N
Molecular Formula	C4HF3N2

7-Chloropyrazolo[1,5-a]pyrimidine, 95%

CAS: 58347-49-2 Molecular Formula: C₆H₄ClN₃ Molecular Weight (g/mol): 153.57 MDL Number: MFCD04035684 InChI Key: YCZQHXPIKQHABJ-UHFFFAOYSA-N Synonym: 7-chloropyrazolo 1,5-a pyrimidine,pyrazolo 1,5-a pyrimidine, 7-chloro,7-chloro-pyrazolo 1,5-a pyrimidine,zlchem 1087,7-chloropyrazolo 1?5-a pyrimidine,7-chloranylpyrazolo 1,5-a pyrimidine,7-chloro-8-hydropyrazolo 1,5-a pyrimidine PubChem CID: 12281647 IUPAC Name: 7-chloropyrazolo[1,5-a]pyrimidine SMILES: C1=C2N=CC=C(N2N=C1)Cl

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Specifications

PubChem CID	12281647
CAS	58347-49-2
Molecular Weight (g/mol)	153.57
MDL Number	MFCD04035684
SMILES	C1=C2N=CC=C(N2N=C1)Cl
Synonym	7-chloropyrazolo 1,5-a pyrimidine,pyrazolo 1,5-a pyrimidine, 7-chloro,7-chloro-pyrazolo 1,5-a pyrimidine,zlchem 1087,7-chloropyrazolo 1?5-a pyrimidine,7-chloranylpyrazolo 1,5-a pyrimidine,7-chloro-8-hydropyrazolo 1,5-a pyrimidine
IUPAC Name	7-chloropyrazolo[1,5-a]pyrimidine
InChI Key	YCZQHXPIKQHABJ-UHFFFAOYSA-N
Molecular Formula	C₆H₄ClN₃

Thermo Scientific Chemicals Thiamine hydrochloride, 98.5-101.5%

CAS: 67-03-8 Molecular Formula: C₁₂H₁₇ClN₄OS·HCl Molecular Weight (g/mol): 337.26 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-]

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Specifications

PubChem CID	6202
CAS	67-03-8
Molecular Weight (g/mol)	337.26
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	C₁₂H₁₇ClN₄OS·HCl

4-Chloro-2-(4-morpholinyl)quinazoline, 97%

CAS: 39216-67-6 Molecular Formula: C12H12ClN3O Molecular Weight (g/mol): 249.70 MDL Number: MFCD07758764 InChI Key: UWAUCVLFWGAOGM-UHFFFAOYSA-N Synonym: 4-chloro-2-morpholinoquinazoline,4-chloro-2-morpholin-4-yl quinazoline,4-4-chloroquinazolin-2-yl morpholine,4-chloro-2-4-morpholinyl quinazoline PubChem CID: 12286589 IUPAC Name: 4-(4-chloroquinazolin-2-yl)morpholine SMILES: ClC1=C2C=CC=CC2=NC(=N1)N1CCOCC1

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Specifications

PubChem CID	12286589
CAS	39216-67-6
Molecular Weight (g/mol)	249.70
MDL Number	MFCD07758764
SMILES	ClC1=C2C=CC=CC2=NC(=N1)N1CCOCC1
Synonym	4-chloro-2-morpholinoquinazoline,4-chloro-2-morpholin-4-yl quinazoline,4-4-chloroquinazolin-2-yl morpholine,4-chloro-2-4-morpholinyl quinazoline
IUPAC Name	4-(4-chloroquinazolin-2-yl)morpholine
InChI Key	UWAUCVLFWGAOGM-UHFFFAOYSA-N
Molecular Formula	C12H12ClN3O

2-Methylpyrimidine-5-carboxylic acid, 97%

CAS: 5194-32-1 Molecular Formula: C6H6N2O2 Molecular Weight (g/mol): 138.126 MDL Number: MFCD08235210 InChI Key: NMGIXZFBQPETOK-UHFFFAOYSA-N Synonym: 2-methyl-5-pyrimidinecarboxylic acid,2-methylpyrimidine-5-carboxylicacid,5-pyrimidinecarboxylic acid, 2-methyl,2-methyl-5-pyrimidinecarboxylicacid,pubchem13290,acmc-209kwu,ksc269i7t,2-methyl-pyrimidine-5-carboxylic acid,5-pyrimidinecarboxylicacid, 2-methyl,2-methyl pyrimidine-5-carboxylic acid PubChem CID: 13670875 IUPAC Name: 2-methylpyrimidine-5-carboxylic acid SMILES: CC1=NC=C(C=N1)C(=O)O

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Specifications

PubChem CID	13670875
CAS	5194-32-1
Molecular Weight (g/mol)	138.126
MDL Number	MFCD08235210
SMILES	CC1=NC=C(C=N1)C(=O)O
Synonym	2-methyl-5-pyrimidinecarboxylic acid,2-methylpyrimidine-5-carboxylicacid,5-pyrimidinecarboxylic acid, 2-methyl,2-methyl-5-pyrimidinecarboxylicacid,pubchem13290,acmc-209kwu,ksc269i7t,2-methyl-pyrimidine-5-carboxylic acid,5-pyrimidinecarboxylicacid, 2-methyl,2-methyl pyrimidine-5-carboxylic acid
IUPAC Name	2-methylpyrimidine-5-carboxylic acid
InChI Key	NMGIXZFBQPETOK-UHFFFAOYSA-N
Molecular Formula	C6H6N2O2

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

Methyl 2,4-dichloropyrimidine-6-carboxylate, 98%

CAS: 6299-85-0 Molecular Formula: C₆H₄Cl₂N₂O₂ Molecular Weight (g/mol): 207.02 InChI Key: DQNQNLWKAGZNIT-UHFFFAOYSA-N Synonym: methyl 2,4-dichloropyrimidine-6-carboxylate,methyl 2,4-dichloro-pyrimidine-6-carboxylate,2,6-dichloropyrimidine-4-carboxylic acid methyl ester,4-pyrimidinecarboxylic acid, 2,6-dichloro-, methyl ester,2,6-dichloro-4-pyrimidinecarboxylicacid methyl ester,t6n cnj bg dvo1 fg wln,zlchem 33,pubchem23452,methyl2,6-dichloropyrimidine-4-carboxylate,2,4-dichloro-6-methoxycarbonyl pyrimidine PubChem CID: 239689 IUPAC Name: methyl 2,6-dichloropyrimidine-4-carboxylate SMILES: COC(=O)C1=CC(=NC(=N1)Cl)Cl

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Specifications

PubChem CID	239689
CAS	6299-85-0
Molecular Weight (g/mol)	207.02
SMILES	COC(=O)C1=CC(=NC(=N1)Cl)Cl
Synonym	methyl 2,4-dichloropyrimidine-6-carboxylate,methyl 2,4-dichloro-pyrimidine-6-carboxylate,2,6-dichloropyrimidine-4-carboxylic acid methyl ester,4-pyrimidinecarboxylic acid, 2,6-dichloro-, methyl ester,2,6-dichloro-4-pyrimidinecarboxylicacid methyl ester,t6n cnj bg dvo1 fg wln,zlchem 33,pubchem23452,methyl2,6-dichloropyrimidine-4-carboxylate,2,4-dichloro-6-methoxycarbonyl pyrimidine
IUPAC Name	methyl 2,6-dichloropyrimidine-4-carboxylate
InChI Key	DQNQNLWKAGZNIT-UHFFFAOYSA-N
Molecular Formula	C₆H₄Cl₂N₂O₂

4,6-Dichloropyrimidine, 97%

CAS: 1193-21-1 Molecular Formula: C4H2Cl2N2 Molecular Weight (g/mol): 148.97 MDL Number: MFCD00006109 InChI Key: XJPZKYIHCLDXST-UHFFFAOYSA-N Synonym: pyrimidine, 4,6-dichloro,4,6-dichloro-pyrimidine,4,6-dichloro pyrimidine,4,6-dichloro-1,3-diazine,4,6-dichlorpyrimidin,dichloropyrmidine,dichloropyrimidine,zlchem 225,pubchem6913,4,6-dichloropyrimdine PubChem CID: 70943 IUPAC Name: 4,6-dichloropyrimidine SMILES: ClC1=CC(Cl)=NC=N1

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Specifications

PubChem CID	70943
CAS	1193-21-1
Molecular Weight (g/mol)	148.97
MDL Number	MFCD00006109
SMILES	ClC1=CC(Cl)=NC=N1
Synonym	pyrimidine, 4,6-dichloro,4,6-dichloro-pyrimidine,4,6-dichloro pyrimidine,4,6-dichloro-1,3-diazine,4,6-dichlorpyrimidin,dichloropyrmidine,dichloropyrimidine,zlchem 225,pubchem6913,4,6-dichloropyrimdine
IUPAC Name	4,6-dichloropyrimidine
InChI Key	XJPZKYIHCLDXST-UHFFFAOYSA-N
Molecular Formula	C4H2Cl2N2

3-Pyrimidin-5-ylaniline, ≥97%, Thermo Scientific™

CAS: 69491-59-4 Molecular Formula: C10H9N3 Molecular Weight (g/mol): 171.203 MDL Number: MFCD06802522 InChI Key: DZEIKJMNXHOFHL-UHFFFAOYSA-N PubChem CID: 7162049 IUPAC Name: 3-pyrimidin-5-ylaniline SMILES: C1=CC(=CC(=C1)N)C2=CN=CN=C2

Pricing and Availability
Specifications

PubChem CID	7162049
CAS	69491-59-4
Molecular Weight (g/mol)	171.203
MDL Number	MFCD06802522
SMILES	C1=CC(=CC(=C1)N)C2=CN=CN=C2
IUPAC Name	3-pyrimidin-5-ylaniline
InChI Key	DZEIKJMNXHOFHL-UHFFFAOYSA-N
Molecular Formula	C10H9N3

6-Chloro-2,4-dimethoxypyrimidine, 98+%

CAS: 6320-15-6 Molecular Formula: C6H7ClN2O2 Molecular Weight (g/mol): 174.58 MDL Number: MFCD00006068 InChI Key: JHNRTJRDRWKAIW-UHFFFAOYSA-N Synonym: 6-chloro-2,4-dimethoxypyrimidine,2,4-dimethoxy-6-chloropyrimidine,pyrimidine, 4-chloro-2,6-dimethoxy,4-chloro-2,6-dimethoxy-pyrimidine,pubchem16350,acmc-209ndu,4-chlor-2,6-dimethoxypyrimidin,4-chloro-2,6-dimethoxypyrimidin,2,6-dimethoxy-4-chloropyrimidine,6-chloro-2,4-dimethixypyrimidine PubChem CID: 80600 IUPAC Name: 4-chloro-2,6-dimethoxypyrimidine SMILES: COC1=CC(Cl)=NC(OC)=N1

Pricing and Availability
Specifications

PubChem CID	80600
CAS	6320-15-6
Molecular Weight (g/mol)	174.58
MDL Number	MFCD00006068
SMILES	COC1=CC(Cl)=NC(OC)=N1
Synonym	6-chloro-2,4-dimethoxypyrimidine,2,4-dimethoxy-6-chloropyrimidine,pyrimidine, 4-chloro-2,6-dimethoxy,4-chloro-2,6-dimethoxy-pyrimidine,pubchem16350,acmc-209ndu,4-chlor-2,6-dimethoxypyrimidin,4-chloro-2,6-dimethoxypyrimidin,2,6-dimethoxy-4-chloropyrimidine,6-chloro-2,4-dimethixypyrimidine
IUPAC Name	4-chloro-2,6-dimethoxypyrimidine
InChI Key	JHNRTJRDRWKAIW-UHFFFAOYSA-N
Molecular Formula	C6H7ClN2O2

4-Chloro-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidine, 96%

CAS: 300816-22-2 Molecular Formula: C9H7ClN2S Molecular Weight (g/mol): 210.68 MDL Number: MFCD00572400 InChI Key: JKXJMJPJOYMQSK-UHFFFAOYSA-N PubChem CID: 789817 IUPAC Name: 1-chloro-7,8-dihydro-6H-cyclopenta[2,3]thieno[2,4-d]pyrimidine SMILES: ClC1=C2C3=C(CCC3)SC2=NC=N1

Pricing and Availability
Specifications

PubChem CID	789817
CAS	300816-22-2
Molecular Weight (g/mol)	210.68
MDL Number	MFCD00572400
SMILES	ClC1=C2C3=C(CCC3)SC2=NC=N1
IUPAC Name	1-chloro-7,8-dihydro-6H-cyclopenta[2,3]thieno[2,4-d]pyrimidine
InChI Key	JKXJMJPJOYMQSK-UHFFFAOYSA-N
Molecular Formula	C9H7ClN2S

Ethyl 2-thiouracil-5-carboxylate, 99%

CAS: 38026-46-9 Molecular Formula: C7H8N2O3S Molecular Weight (g/mol): 200.21 MDL Number: MFCD00006074 InChI Key: FQFSHLBWRUOCPX-UHFFFAOYSA-N Synonym: 5-carbethoxy-2-thiouracil,ethyl 2-thiouracil-5-carboxylate,2-mercapto-5-carbethoxyuracil,5-ethoxycarbonyl-2-thiouracil,uracil, 5-carbethoxy-2-thio,ethyl 4-hydroxy-2-mercaptopyrimidine-5-carboxylate,5-carboethoxy-2-thiouracil,ethyl 4-oxo-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate,5-pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-4-oxo-2-thio-, ethyl ester,5-pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-4-oxo-2-thioxo-, ethyl ester PubChem CID: 735952 IUPAC Name: ethyl 4-oxo-2-sulfanylidene-1H-pyrimidine-5-carboxylate SMILES: CCOC(=O)C1=CNC(=S)NC1=O

Pricing and Availability
Specifications

PubChem CID	735952
CAS	38026-46-9
Molecular Weight (g/mol)	200.21
MDL Number	MFCD00006074
SMILES	CCOC(=O)C1=CNC(=S)NC1=O
Synonym	5-carbethoxy-2-thiouracil,ethyl 2-thiouracil-5-carboxylate,2-mercapto-5-carbethoxyuracil,5-ethoxycarbonyl-2-thiouracil,uracil, 5-carbethoxy-2-thio,ethyl 4-hydroxy-2-mercaptopyrimidine-5-carboxylate,5-carboethoxy-2-thiouracil,ethyl 4-oxo-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate,5-pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-4-oxo-2-thio-, ethyl ester,5-pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-4-oxo-2-thioxo-, ethyl ester
IUPAC Name	ethyl 4-oxo-2-sulfanylidene-1H-pyrimidine-5-carboxylate
InChI Key	FQFSHLBWRUOCPX-UHFFFAOYSA-N
Molecular Formula	C7H8N2O3S

Pyrimidines And Derivatives

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