Vitas-M small molecule compound

4-(2-chlorophenyl)-5-cyano-2-methyl-N-(2-methylphenyl)-6-[(2-oxo-2-phenylethyl)sulfanyl]-1,4-dihydropyridine-3-carboxamide

Catalog ID
STK725823
SMILES N#CC1=C(SCC(=O)c2ccccc2)NC(=C(C1c1ccccc1Cl)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 C29H24ClN3O2S MW 514.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24ClN3O2S/c1-18-10-6-9-15-24(18)33-28(35)26-19(2)32-29(36-17-25(34)20-11-4-3-5-12-20)22(16-31)27(26)21-13-7-8-14-23(21)30/h3-15,27,32H,17H2,1-2H3,(H,33,35)
InChIKey
JBLQBQVSJQKZSC-UHFFFAOYSA-N
Synonyms

4(2chlorophenyl)5cyano2methyl6((2oxo2phenylethyl)thio)N(otolyl)14dihydropyridine3carboxamide
4(2chlorophenyl)5cyano2methylN(2methylphenyl)6((2oxo2phenylethyl)sulfanyl)14dihydropyridine3carboxamide
4(2CHLOROPHENYL)5CYANO2METHYLN(2METHYLPHENYL)6PHENACYLSULFANYL14DIHYDROPYRIDINE3CARBOXAMIDE
CC1=CC=CC=C1NC(=O)C2=C(NC(=C(C2C3=CC=CC=C3Cl)C#N)SCC(=O)C4=CC=CC=C4)C
InChI=1SC29H24ClN3O2Sc11810691524(18)3328(35)2619(2)3229(361725(34)20114351220)22(1631)27(26)2113781423(21)30h3152732H17H212H3(H3335)
MFCD01932626
ZINC000009310828
ZINC000009311045

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.