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

Systemtic Name: (4S)-5-cyano-N-(2-methoxyphenyl)-2-methyl-6-methylsulfanyl-4-phenyl-3,4-dihydropyridine-3-carboxamide Openeye Name: (4S)-5-cyano-N-(2-methoxyphenyl)-2-methyl-6-methylsulfanyl-4-phenyl-3,4-dihydropyridine-3-carboxamide CAS Name: (4S)-5-cyano-N-(2-methoxyphenyl)-2-methyl-6-(methylthio)-4-phenyl-3,4-dihydropyridine-3-carboxamide IUPAC Name: (4S)-5-cyano-N-(2-methoxyphenyl)-2-methyl-6-methylsulfanyl-4-phenyl-3,4-dihydropyridine-3-carboxamide Traditional Name: (4S)-5-cyano-N-(2-methoxyphenyl)-2-methyl-6-(methylthio)-4-phenyl-3,4-dihydropyridine-3-carboxamide Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1C(=O)NC2=CC=CC=C2OC)C3=CC=CC=C3)C#N)SC

Isomeric SMILES

CC1=NC(=C([C@@H](C1C(=O)NC2=CC=CC=C2OC)C3=CC=CC=C3)C#N)SC

InChI

InChI=1S/C22H21N3O2S/c1-14-19(21(26)25-17-11-7-8-12-18(17)27-2)20(15-9-5-4-6-10-15)16(13-23)22(24-14)28-3/h4-12,19-20H,1-3H3,(H,25,26)/t19?,20-/m0/s1