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

Systemtic Name: 2-[3-cyano-6-phenyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(4-fluoranyl-2-methyl-phenyl)ethanamide Openeye Name: 2-[[3-cyano-6-phenyl-4-(trifluoromethyl)-2-pyridyl]sulfanyl]-N-(4-fluoro-2-methyl-phenyl)acetamide CAS Name: 2-[[3-cyano-6-phenyl-4-(trifluoromethyl)-2-pyridinyl]thio]-N-(4-fluoro-2-methylphenyl)acetamide IUPAC Name: 2-[3-cyano-6-phenyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(4-fluoro-2-methylphenyl)acetamide Traditional Name: 2-[[3-cyano-6-phenyl-4-(trifluoromethyl)-2-pyridyl]thio]-N-(4-fluoro-2-methyl-phenyl)acetamide Formula: C22H15F4N3OS MolecularWeight: 445.432613

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)NC(=O)CSC2=C(C(=CC(=N2)C3=CC=CC=C3)C(F)(F)F)C#N

Isomeric SMILES

CC1=C(C=CC(=C1)F)NC(=O)CSC2=C(C(=CC(=N2)C3=CC=CC=C3)C(F)(F)F)C#N

InChI

InChI=1S/C22H15F4N3OS/c1-13-9-15(23)7-8-18(13)28-20(30)12-31-21-16(11-27)17(22(24,25)26)10-19(29-21)14-5-3-2-4-6-14/h2-10H,12H2,1H3,(H,28,30)