Vitas-M small molecule compound
4-hydroxy-2-(4-nitrophenyl)-1-phenyl-6-sulfanyl-1,2-dihydropyrimidine-5-carbonitrile
Catalog ID
STK598335
SMILES N#CC1=C(S)N(C(N=C1O)c1ccc(cc1)[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(11-6-8-13(9-7-11)21(23)24)20(17(14)25)12-4-2-1-3-5-12/h1-9,15,25H,(H,19,22)InChIKey
YPMMNRNKQVSJHB-UHFFFAOYSA-NSynonyms
501351-41-32(4NITROPHENYL)6OXO3PHENYL4SULFANYL123TRIHYDROPYRIMIDINE5CARBONITRILE
2(4NITROPHENYL)6OXO3PHENYL4SULFANYL12DIHYDROPYRIMIDINE5CARBONITRILE
4hydroxy2(4nitrophenyl)1phenyl6sulfanyl12dihydropyrimidine5carbonitrile
C1=CC=C(C=C1)N2C(NC(=O)C(=C2S)C#N)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC17H12N4O3Sc18101416(22)1915(116813(9711)21(23)24)20(17(14)25)124213512h191525H(H1922)
MFCD07203076
N#CC1=C(S)N(C(N=C1O)c1ccc(cc1)(N+)(=O)(O))c1ccccc1
ZINC000009111551
ZINC000009111552
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