5-cyano-2-methyl-6-[(3-methylphenyl)methylsulfanyl]-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide

Systemtic Name: 5-cyano-2-methyl-6-[(3-methylphenyl)methylsulfanyl]-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide Openeye Name: 5-cyano-2-methyl-6-(m-tolylmethylsulfanyl)-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide CAS Name: 5-cyano-2-methyl-6-[(3-methylphenyl)methylthio]-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide IUPAC Name: 5-cyano-2-methyl-6-[(3-methylphenyl)methylsulfanyl]-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide Traditional Name: 5-cyano-2-methyl-6-[(3-methylbenzyl)thio]-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide Formula: C28H25N3OS MolecularWeight: 451.5826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC2=C(C(C(=C(N2)C)C(=O)NC3=CC=CC=C3)C4=CC=CC=C4)C#N

Isomeric SMILES

CC1=CC(=CC=C1)CSC2=C(C(C(=C(N2)C)C(=O)NC3=CC=CC=C3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C28H25N3OS/c1-19-10-9-11-21(16-19)18-33-28-24(17-29)26(22-12-5-3-6-13-22)25(20(2)30-28)27(32)31-23-14-7-4-8-15-23/h3-16,26,30H,18H2,1-2H3,(H,31,32)