Vitas-M small molecule compound

4-(2-chlorophenyl)-5-cyano-2-methyl-6-[(2-oxo-2-{[2-(trifluoromethyl)phenyl]amino}ethyl)sulfanyl]-N-phenyl-1,4-dihydropyridine-3-carboxamide

Catalog ID
STK887199
SMILES N#CC1=C(SCC(=O)Nc2ccccc2C(F)(F)F)NC(=C(C1c1ccccc1Cl)C(=O)Nc1ccccc1)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 C29H22ClF3N4O2S MW 583.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H22ClF3N4O2S/c1-17-25(27(39)36-18-9-3-2-4-10-18)26(19-11-5-7-13-22(19)30)20(15-34)28(35-17)40-16-24(38)37-23-14-8-6-12-21(23)29(31,32)33/h2-14,26,35H,16H2,1H3,(H,36,39)(H,37,38)
InChIKey
SUQAZNSFBRVFRL-UHFFFAOYSA-N
Synonyms

4(2chlorophenyl)5cyano2methyl6((2oxo2((2(trifluoromethyl)phenyl)amino)ethyl)sulfanyl)Nphenyl14dihydropyridine3carboxamide
4(2CHLOROPHENYL)5CYANO2METHYL6((2OXO2(2(TRIFLUOROMETHYL)ANILINO)ETHYL)SULFANYL)NPHENYL14DIHYDRO3PYRIDINECARBOXAMIDE
4(2CHLOROPHENYL)5CYANO2METHYL6(2OXO2(2(TRIFLUOROMETHYL)ANILINO)ETHYL)SULFANYLNPHENYL14DIHYDROPYRIDINE3CARBOXAMIDE
CC1=C(C(C(=C(N1)SCC(=O)NC2=CC=CC=C2C(F)(F)F)C#N)C3=CC=CC=C3Cl)C(=O)NC4=CC=CC=C4
InChI=1SC29H22ClF3N4O2Sc11725(27(39)361893241018)26(1911571322(19)30)20(1534)28(3517)401624(38)372314861221(23)29(3132)33h2142635H16H21H3(H3639)(H3738)
MFCD03723912
ZINC000101721206
ZINC000101721210

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Available files

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