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

Systemtic Name: (4S)-5-cyano-2-methyl-6-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-phenyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide Openeye Name: (4S)-5-cyano-2-methyl-6-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-N-phenyl-4-(2-thienyl)-1,4-dihydropyridine-3-carboxamide CAS Name: (4S)-5-cyano-2-methyl-6-[[2-(4-methylanilino)-2-oxoethyl]thio]-N-phenyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide IUPAC Name: (4S)-5-cyano-2-methyl-6-[2-(4-methylanilino)-2-oxoethyl]sulfanyl-N-phenyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide Traditional Name: (4S)-5-cyano-6-[[2-keto-2-(p-toluidino)ethyl]thio]-2-methyl-N-phenyl-4-(2-thienyl)-1,4-dihydropyridine-3-carboxamide Formula: C27H24N4O2S2 MolecularWeight: 500.63506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)NC3=CC=CC=C3)C4=CC=CS4)C#N

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSC2=C([C@H](C(=C(N2)C)C(=O)NC3=CC=CC=C3)C4=CC=CS4)C#N

InChI

InChI=1S/C27H24N4O2S2/c1-17-10-12-20(13-11-17)30-23(32)16-35-27-21(15-28)25(22-9-6-14-34-22)24(18(2)29-27)26(33)31-19-7-4-3-5-8-19/h3-14,25,29H,16H2,1-2H3,(H,30,32)(H,31,33)/t25-/m0/s1