Vitas-M small molecule compound
1-(2-ethylphenyl)-2-(4-nitrophenyl)-4-oxo-6-sulfanyl-1,2,3,4-tetrahydropyrimidine-5-carbonitrile
Catalog ID
STK951101
SMILES N#CC1=C(S)N(C(NC1=O)c1ccc(cc1)[N+](=O)[O-])c1ccccc1CC
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C19H16N4O3S MW 380.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N4O3S/c1-2-12-5-3-4-6-16(12)22-17(21-18(24)15(11-20)19(22)27)13-7-9-14(10-8-13)23(25)26/h3-10,17,27H,2H2,1H3,(H,21,24)InChIKey
VTSUCKDFRRKIDI-UHFFFAOYSA-NSynonyms
1(2ethylphenyl)2(4nitrophenyl)4oxo6sulfanyl1234tetrahydropyrimidine5carbonitrile
3(2ETHYLPHENYL)2(4NITROPHENYL)6OXO4SULFANYL123TRIHYDROPYRIMIDINE5CARBONITRILE
3(2ETHYLPHENYL)2(4NITROPHENYL)6OXO4SULFANYL12DIHYDROPYRIMIDINE5CARBONITRILE
CCC1=CC=CC=C1N2C(NC(=O)C(=C2S)C#N)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC19H16N4O3Sc1212534616(12)2217(2118(24)15(1120)19(22)27)137914(10813)23(25)26h3101727H2H21H3(H2124)
MFCD06651103
N#CC1=C(S)N(C(NC1=O)c1ccc(cc1)(N+)(=O)(O))c1ccccc1CC
ZINC000004513614
ZINC000004513619
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