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

Systemtic Name: 2-[3-cyano-6-(4-methylphenyl)-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-phenyl-ethanamide Openeye Name: 2-[[3-cyano-6-(p-tolyl)-4-(trifluoromethyl)-2-pyridyl]sulfanyl]-N-phenyl-acetamide CAS Name: 2-[[3-cyano-6-(4-methylphenyl)-4-(trifluoromethyl)-2-pyridinyl]thio]-N-phenylacetamide IUPAC Name: 2-[3-cyano-6-(4-methylphenyl)-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-phenylacetamide Traditional Name: 2-[[3-cyano-6-(p-tolyl)-4-(trifluoromethyl)-2-pyridyl]thio]-N-phenyl-acetamide Formula: C22H16F3N3OS MolecularWeight: 427.44215

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C(F)(F)F)C#N)SCC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C(F)(F)F)C#N)SCC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H16F3N3OS/c1-14-7-9-15(10-8-14)19-11-18(22(23,24)25)17(12-26)21(28-19)30-13-20(29)27-16-5-3-2-4-6-16/h2-11H,13H2,1H3,(H,27,29)