propan-2-yl (4S)-4-(4-chlorophenyl)-5-cyano-2-methyl-6-methylsulfanyl-3,4-dihydropyridine-3-carboxylate

Systemtic Name: propan-2-yl (4S)-4-(4-chlorophenyl)-5-cyano-2-methyl-6-methylsulfanyl-3,4-dihydropyridine-3-carboxylate Openeye Name: isopropyl (4S)-4-(4-chlorophenyl)-5-cyano-2-methyl-6-methylsulfanyl-3,4-dihydropyridine-3-carboxylate CAS Name: (4S)-4-(4-chlorophenyl)-5-cyano-2-methyl-6-(methylthio)-3,4-dihydropyridine-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl (4S)-4-(4-chlorophenyl)-5-cyano-2-methyl-6-methylsulfanyl-3,4-dihydropyridine-3-carboxylate Traditional Name: (4S)-4-(4-chlorophenyl)-5-cyano-2-methyl-6-(methylthio)-3,4-dihydropyridine-3-carboxylic acid isopropyl ester Formula: C18H19ClN2O2S MolecularWeight: 362.87366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1C(=O)OC(C)C)C2=CC=C(C=C2)Cl)C#N)SC

Isomeric SMILES

CC1=NC(=C([C@@H](C1C(=O)OC(C)C)C2=CC=C(C=C2)Cl)C#N)SC

InChI

InChI=1S/C18H19ClN2O2S/c1-10(2)23-18(22)15-11(3)21-17(24-4)14(9-20)16(15)12-5-7-13(19)8-6-12/h5-8,10,15-16H,1-4H3/t15?,16-/m0/s1