N-(4-chlorophenyl)-5-cyano-2-methyl-6-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-1,4-dihydropyridine-3-carboxamide

Systemtic Name: N-(4-chlorophenyl)-5-cyano-2-methyl-6-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-1,4-dihydropyridine-3-carboxamide Openeye Name: N-(4-chlorophenyl)-5-cyano-2-methyl-6-[2-(3-methylanilino)-2-oxo-ethyl]sulfanyl-4-phenyl-1,4-dihydropyridine-3-carboxamide CAS Name: N-(4-chlorophenyl)-5-cyano-2-methyl-6-[[2-(3-methylanilino)-2-oxoethyl]thio]-4-phenyl-1,4-dihydropyridine-3-carboxamide IUPAC Name: N-(4-chlorophenyl)-5-cyano-2-methyl-6-[2-(3-methylanilino)-2-oxoethyl]sulfanyl-4-phenyl-1,4-dihydropyridine-3-carboxamide Traditional Name: N-(4-chlorophenyl)-5-cyano-6-[[2-keto-2-(m-toluidino)ethyl]thio]-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxamide Formula: C29H25ClN4O2S MolecularWeight: 529.0524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)NC3=CC=C(C=C3)Cl)C4=CC=CC=C4)C#N

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)NC3=CC=C(C=C3)Cl)C4=CC=CC=C4)C#N

InChI

InChI=1S/C29H25ClN4O2S/c1-18-7-6-10-23(15-18)33-25(35)17-37-29-24(16-31)27(20-8-4-3-5-9-20)26(19(2)32-29)28(36)34-22-13-11-21(30)12-14-22/h3-15,27,32H,17H2,1-2H3,(H,33,35)(H,34,36)