(4S)-3-cyano-6-methyl-N,4-diphenyl-2-propylsulfanyl-3,4-dihydropyridine-5-carboxamide

Systemtic Name: (4S)-3-cyano-6-methyl-N,4-diphenyl-2-propylsulfanyl-3,4-dihydropyridine-5-carboxamide Openeye Name: (4S)-3-cyano-6-methyl-N,4-diphenyl-2-propylsulfanyl-3,4-dihydropyridine-5-carboxamide CAS Name: (4S)-3-cyano-6-methyl-N,4-diphenyl-2-(propylthio)-3,4-dihydropyridine-5-carboxamide IUPAC Name: (4S)-3-cyano-6-methyl-N,4-diphenyl-2-propylsulfanyl-3,4-dihydropyridine-5-carboxamide Traditional Name: (4S)-3-cyano-6-methyl-N,4-diphenyl-2-(propylthio)-3,4-dihydropyridine-5-carboxamide Formula: C23H23N3OS MolecularWeight: 389.51322

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC(=C(C(C1C#N)C2=CC=CC=C2)C(=O)NC3=CC=CC=C3)C

Isomeric SMILES

CCCSC1=NC(=C([C@@H](C1C#N)C2=CC=CC=C2)C(=O)NC3=CC=CC=C3)C

InChI

InChI=1S/C23H23N3OS/c1-3-14-28-23-19(15-24)21(17-10-6-4-7-11-17)20(16(2)25-23)22(27)26-18-12-8-5-9-13-18/h4-13,19,21H,3,14H2,1-2H3,(H,26,27)/t19?,21-/m1/s1