methyl (4S)-4-(4-chlorophenyl)-6-[2-[(3-chlorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-5-cyano-2-methyl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: methyl (4S)-4-(4-chlorophenyl)-6-[2-[(3-chlorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-5-cyano-2-methyl-1,4-dihydropyridine-3-carboxylate Openeye Name: methyl (4S)-6-[2-(3-chloroanilino)-2-oxo-ethyl]sulfanyl-4-(4-chlorophenyl)-5-cyano-2-methyl-1,4-dihydropyridine-3-carboxylate CAS Name: (4S)-6-[[2-(3-chloroanilino)-2-oxoethyl]thio]-4-(4-chlorophenyl)-5-cyano-2-methyl-1,4-dihydropyridine-3-carboxylic acid methyl ester IUPAC Name: methyl (4S)-6-[2-(3-chloroanilino)-2-oxoethyl]sulfanyl-4-(4-chlorophenyl)-5-cyano-2-methyl-1,4-dihydropyridine-3-carboxylate Traditional Name: (4S)-6-[[2-(3-chloroanilino)-2-keto-ethyl]thio]-4-(4-chlorophenyl)-5-cyano-2-methyl-1,4-dihydropyridine-3-carboxylic acid methyl ester Formula: C23H19Cl2N3O3S MolecularWeight: 488.38626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)SCC(=O)NC2=CC(=CC=C2)Cl)C#N)C3=CC=C(C=C3)Cl)C(=O)OC

Isomeric SMILES

CC1=C([C@@H](C(=C(N1)SCC(=O)NC2=CC(=CC=C2)Cl)C#N)C3=CC=C(C=C3)Cl)C(=O)OC

InChI

InChI=1S/C23H19Cl2N3O3S/c1-13-20(23(30)31-2)21(14-6-8-15(24)9-7-14)18(11-26)22(27-13)32-12-19(29)28-17-5-3-4-16(25)10-17/h3-10,21,27H,12H2,1-2H3,(H,28,29)/t21-/m1/s1