5-cyano-4-(4-methoxyphenyl)-2-methyl-N-phenyl-6-(phenylmethylsulfanyl)pyridine-3-carboxamide

Systemtic Name: 5-cyano-4-(4-methoxyphenyl)-2-methyl-N-phenyl-6-(phenylmethylsulfanyl)pyridine-3-carboxamide Openeye Name: 6-benzylsulfanyl-5-cyano-4-(4-methoxyphenyl)-2-methyl-N-phenyl-pyridine-3-carboxamide CAS Name: 5-cyano-4-(4-methoxyphenyl)-2-methyl-N-phenyl-6-(phenylmethylthio)-3-pyridinecarboxamide IUPAC Name: 6-benzylsulfanyl-5-cyano-4-(4-methoxyphenyl)-2-methyl-N-phenylpyridine-3-carboxamide Traditional Name: 6-(benzylthio)-5-cyano-4-(4-methoxyphenyl)-2-methyl-N-phenyl-nicotinamide Formula: C28H23N3O2S MolecularWeight: 465.56612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=N1)SCC2=CC=CC=C2)C#N)C3=CC=C(C=C3)OC)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=C(C(=N1)SCC2=CC=CC=C2)C#N)C3=CC=C(C=C3)OC)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C28H23N3O2S/c1-19-25(27(32)31-22-11-7-4-8-12-22)26(21-13-15-23(33-2)16-14-21)24(17-29)28(30-19)34-18-20-9-5-3-6-10-20/h3-16H,18H2,1-2H3,(H,31,32)