(4S)-N-(2-chlorophenyl)-5-cyano-6-(cyanomethylsulfanyl)-2-methyl-4-phenyl-3,4-dihydropyridine-3-carboxamide

Systemtic Name: (4S)-N-(2-chlorophenyl)-5-cyano-6-(cyanomethylsulfanyl)-2-methyl-4-phenyl-3,4-dihydropyridine-3-carboxamide Openeye Name: (4S)-N-(2-chlorophenyl)-5-cyano-6-(cyanomethylsulfanyl)-2-methyl-4-phenyl-3,4-dihydropyridine-3-carboxamide CAS Name: (4S)-N-(2-chlorophenyl)-5-cyano-6-(cyanomethylthio)-2-methyl-4-phenyl-3,4-dihydropyridine-3-carboxamide IUPAC Name: (4S)-N-(2-chlorophenyl)-5-cyano-6-(cyanomethylsulfanyl)-2-methyl-4-phenyl-3,4-dihydropyridine-3-carboxamide Traditional Name: (4S)-N-(2-chlorophenyl)-5-cyano-6-(cyanomethylthio)-2-methyl-4-phenyl-3,4-dihydropyridine-3-carboxamide Formula: C22H17ClN4OS MolecularWeight: 420.91458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1C(=O)NC2=CC=CC=C2Cl)C3=CC=CC=C3)C#N)SCC#N

Isomeric SMILES

CC1=NC(=C([C@@H](C1C(=O)NC2=CC=CC=C2Cl)C3=CC=CC=C3)C#N)SCC#N

InChI

InChI=1S/C22H17ClN4OS/c1-14-19(21(28)27-18-10-6-5-9-17(18)23)20(15-7-3-2-4-8-15)16(13-25)22(26-14)29-12-11-24/h2-10,19-20H,12H2,1H3,(H,27,28)/t19?,20-/m0/s1