Vitas-M small molecule compound
4-[4-(benzyloxy)phenyl]-5-cyano-2-methyl-N-(2-methylphenyl)-6-[(2-oxo-2-{[2-(trifluoromethyl)phenyl]amino}ethyl)sulfanyl]pyridine-3-carboxamide
Catalog ID
STK885772
SMILES N#Cc1c(SCC(=O)Nc2ccccc2C(F)(F)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 C37H29F3N4O3S MW 666.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H29F3N4O3S/c1-23-10-6-8-14-30(23)44-35(46)33-24(2)42-36(48-22-32(45)43-31-15-9-7-13-29(31)37(38,39)40)28(20-41)34(33)26-16-18-27(19-17-26)47-21-25-11-4-3-5-12-25/h3-19H,21-22H2,1-2H3,(H,43,45)(H,44,46)InChIKey
SPQUMDWJVFVIPY-UHFFFAOYSA-NSynonyms
4(4(benzyloxy)phenyl)5cyano2methylN(2methylphenyl)6((2oxo2((2(trifluoromethyl)phenyl)amino)ethyl)sulfanyl)pyridine3carboxamide
5cyano2methylN(2methylphenyl)6(2oxo2(2(trifluoromethyl)anilino)ethyl)sulfanyl4(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=CC=C5C(F)(F)F)C
InChI=1SC37H29F3N4O3Sc12310681430(23)4435(46)3324(2)4236(482232(45)433115971329(31)37(3839)40)28(2041)34(33)26161827(191726)472125114351225h319H2122H212H3(H4345)(H4446)
MFCD10086288
ZINC000098048496
ZINC98048496
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