2-[6-(4-chlorophenyl)-3-cyano-4-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-phenyl-ethanamide

Systemtic Name: 2-[6-(4-chlorophenyl)-3-cyano-4-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-phenyl-ethanamide Openeye Name: 2-[[6-(4-chlorophenyl)-3-cyano-4-(p-tolyl)-2-pyridyl]sulfanyl]-N-phenyl-acetamide CAS Name: 2-[[6-(4-chlorophenyl)-3-cyano-4-(4-methylphenyl)-2-pyridinyl]thio]-N-phenylacetamide IUPAC Name: 2-[6-(4-chlorophenyl)-3-cyano-4-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-phenylacetamide Traditional Name: 2-[[6-(4-chlorophenyl)-3-cyano-4-(p-tolyl)-2-pyridyl]thio]-N-phenyl-acetamide Formula: C27H20ClN3OS MolecularWeight: 469.9852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC(=O)NC3=CC=CC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC(=O)NC3=CC=CC=C3)C4=CC=C(C=C4)Cl

InChI

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