(4S)-6-azanyl-5-cyano-N,4-diphenyl-2-(phenylmethylsulfanyl)-1,4-dihydropyridine-3-carboxamide

Systemtic Name: (4S)-6-azanyl-5-cyano-N,4-diphenyl-2-(phenylmethylsulfanyl)-1,4-dihydropyridine-3-carboxamide Openeye Name: (4S)-6-amino-2-benzylsulfanyl-5-cyano-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide CAS Name: (4S)-6-amino-5-cyano-N,4-diphenyl-2-(phenylmethylthio)-1,4-dihydropyridine-3-carboxamide IUPAC Name: (4S)-6-amino-2-benzylsulfanyl-5-cyano-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide Traditional Name: (4S)-6-amino-2-(benzylthio)-5-cyano-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide Formula: C26H22N4OS MolecularWeight: 438.54408

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=C(C(C(=C(N2)N)C#N)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CSC2=C([C@H](C(=C(N2)N)C#N)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C26H22N4OS/c27-16-21-22(19-12-6-2-7-13-19)23(25(31)29-20-14-8-3-9-15-20)26(30-24(21)28)32-17-18-10-4-1-5-11-18/h1-15,22,30H,17,28H2,(H,29,31)/t22-/m0/s1