5-cyano-2-methyl-6-phenacylsulfanyl-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide

Systemtic Name: 5-cyano-2-methyl-6-phenacylsulfanyl-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide Openeye Name: 5-cyano-2-methyl-6-phenacylsulfanyl-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide CAS Name: 5-cyano-2-methyl-6-(phenacylthio)-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide IUPAC Name: 5-cyano-2-methyl-6-phenacylsulfanyl-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide Traditional Name: 5-cyano-2-methyl-6-(phenacylthio)-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide Formula: C28H23N3O2S MolecularWeight: 465.56612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)SCC(=O)C2=CC=CC=C2)C#N)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(C(=C(N1)SCC(=O)C2=CC=CC=C2)C#N)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C28H23N3O2S/c1-19-25(27(33)31-22-15-9-4-10-16-22)26(21-13-7-3-8-14-21)23(17-29)28(30-19)34-18-24(32)20-11-5-2-6-12-20/h2-16,26,30H,18H2,1H3,(H,31,33)