Vitas-M small molecule compound
4-[4-(benzyloxy)phenyl]-5-cyano-6-({2-[(4-fluorophenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-N-(2-methylphenyl)pyridine-3-carboxamide
Catalog ID
STK885770
SMILES N#Cc1c(SCC(=O)Nc2ccc(cc2)F)nc(c(c1c1ccc(cc1)OCc1ccccc1)C(=O)Nc1ccccc1C)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 C36H29FN4O3S MW 616.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H29FN4O3S/c1-23-8-6-7-11-31(23)41-35(43)33-24(2)39-36(45-22-32(42)40-28-16-14-27(37)15-17-28)30(20-38)34(33)26-12-18-29(19-13-26)44-21-25-9-4-3-5-10-25/h3-19H,21-22H2,1-2H3,(H,40,42)(H,41,43)InChIKey
DCGVGTZLNWIMCA-UHFFFAOYSA-NSynonyms
4(4(benzyloxy)phenyl)5cyano6((2((4fluorophenyl)amino)2oxoethyl)sulfanyl)2methylN(2methylphenyl)pyridine3carboxamide
5cyano6(2(4fluoroanilino)2oxoethyl)sulfanyl2methylN(2methylphenyl)4(4phenylmethoxyphenyl)pyridine3carboxamide
CC1=CC=CC=C1NC(=O)C2=C(N=C(C(=C2C3=CC=C(C=C3)OCC4=CC=CC=C4)C#N)SCC(=O)NC5=CC=C(C=C5)F)C
InChI=1SC36H29FN4O3Sc1238671131(23)4135(43)3324(2)3936(452232(42)4028161427(37)151728)30(2038)34(33)26121829(191326)44212594351025h319H2122H212H3(H4042)(H4143)
MFCD10086286
ZINC000098048493
ZINC98048493
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