Vitas-M small molecule compound
4-({[(3-cyano-4,5,6-trimethylpyridin-2-yl)sulfanyl]acetyl}amino)benzoic acid
Catalog ID
STK333052
SMILES N#Cc1c(SCC(=O)Nc2ccc(cc2)C(=O)O)nc(c(c1C)C)C
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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 C18H17N3O3S MW 355.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N3O3S/c1-10-11(2)15(8-19)17(20-12(10)3)25-9-16(22)21-14-6-4-13(5-7-14)18(23)24/h4-7H,9H2,1-3H3,(H,21,22)(H,23,24)InChIKey
MLXVZQBRYBVQLU-UHFFFAOYSA-NSynonyms
4((((3cyano456trimethylpyridin2yl)sulfanyl)acetyl)amino)benzoicacid
4((2(3CYANO456TRIMETHYLPYRIDIN2YL)SULFANYLACETYL)AMINO)BENZOICACID
CC1=C(N=C(C(=C1C)C#N)SCC(=O)NC2=CC=C(C=C2)C(=O)O)C
InChI=1SC18H17N3O3Sc11011(2)15(819)17(2012(10)3)25916(22)21146413(5714)18(23)24h47H9H213H3(H2122)(H2324)
MFCD01807646
ZINC000005587268
ZINC5587268
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