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

Systemtic Name: 4-(3-chlorophenyl)-5-cyano-2-methyl-N-phenyl-6-(phenylmethylsulfanyl)pyridine-3-carboxamide Openeye Name: 6-benzylsulfanyl-4-(3-chlorophenyl)-5-cyano-2-methyl-N-phenyl-pyridine-3-carboxamide CAS Name: 4-(3-chlorophenyl)-5-cyano-2-methyl-N-phenyl-6-(phenylmethylthio)-3-pyridinecarboxamide IUPAC Name: 6-benzylsulfanyl-4-(3-chlorophenyl)-5-cyano-2-methyl-N-phenylpyridine-3-carboxamide Traditional Name: 6-(benzylthio)-4-(3-chlorophenyl)-5-cyano-2-methyl-N-phenyl-nicotinamide Formula: C27H20ClN3OS MolecularWeight: 469.9852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H20ClN3OS/c1-18-24(26(32)31-22-13-6-3-7-14-22)25(20-11-8-12-21(28)15-20)23(16-29)27(30-18)33-17-19-9-4-2-5-10-19/h2-15H,17H2,1H3,(H,31,32)