(4S)-5-cyano-6-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-2-methyl-N,4-diphenyl-3,4-dihydropyridine-3-carboxamide

Systemtic Name: (4S)-5-cyano-6-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-2-methyl-N,4-diphenyl-3,4-dihydropyridine-3-carboxamide Openeye Name: (4S)-5-cyano-6-[2-(4-methoxyanilino)-2-oxo-ethyl]sulfanyl-2-methyl-N,4-diphenyl-3,4-dihydropyridine-3-carboxamide CAS Name: (4S)-5-cyano-6-[[2-(4-methoxyanilino)-2-oxoethyl]thio]-2-methyl-N,4-diphenyl-3,4-dihydropyridine-3-carboxamide IUPAC Name: (4S)-5-cyano-6-[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl-2-methyl-N,4-diphenyl-3,4-dihydropyridine-3-carboxamide Traditional Name: (4S)-5-cyano-6-[[2-keto-2-(p-anisidino)ethyl]thio]-2-methyl-N,4-diphenyl-3,4-dihydropyridine-3-carboxamide Formula: C29H26N4O3S MolecularWeight: 510.60674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1C(=O)NC2=CC=CC=C2)C3=CC=CC=C3)C#N)SCC(=O)NC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=NC(=C([C@@H](C1C(=O)NC2=CC=CC=C2)C3=CC=CC=C3)C#N)SCC(=O)NC4=CC=C(C=C4)OC

InChI

InChI=1S/C29H26N4O3S/c1-19-26(28(35)33-21-11-7-4-8-12-21)27(20-9-5-3-6-10-20)24(17-30)29(31-19)37-18-25(34)32-22-13-15-23(36-2)16-14-22/h3-16,26-27H,18H2,1-2H3,(H,32,34)(H,33,35)/t26?,27-/m0/s1