Vitas-M small molecule compound
4-hydroxy-2-(3-nitrophenyl)-1-phenyl-6-sulfanyl-1,2-dihydropyrimidine-5-carbonitrile
Catalog ID
STK573247
SMILES N#CC1=C(S)N(C(N=C1O)c1cccc(c1)[N+](=O)[O-])c1ccccc1
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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 C17H12N4O3S MW 352.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12N4O3S/c18-10-14-16(22)19-15(11-5-4-8-13(9-11)21(23)24)20(17(14)25)12-6-2-1-3-7-12/h1-9,15,25H,(H,19,22)InChIKey
JRAHJOUJFQVGQC-UHFFFAOYSA-NSynonyms
501351-40-22(3NITROPHENYL)6OXO3PHENYL4SULFANYL12DIHYDROPYRIMIDINE5CARBONITRILE
4hydroxy2(3nitrophenyl)1phenyl6sulfanyl12dihydropyrimidine5carbonitrile
501351402
C1=CC=C(C=C1)N2C(NC(=O)C(=C2S)C#N)C3=CC(=CC=C3)(N+)(=O)(O)
InChI=1SC17H12N4O3Sc18101416(22)1915(1154813(911)21(23)24)20(17(14)25)126213712h191525H(H1922)
MFCD07205217
N#CC1=C(S)N(C(N=C1O)c1cccc(c1)(N+)(=O)(O))c1ccccc1
ZINC000009089674
ZINC000009089675
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