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

Systemtic Name: 2-[3-cyano-6-(4-methylphenyl)-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-cyclopropyl-ethanamide Openeye Name: 2-[[3-cyano-6-(p-tolyl)-4-(trifluoromethyl)-2-pyridyl]sulfanyl]-N-cyclopropyl-acetamide CAS Name: 2-[[3-cyano-6-(4-methylphenyl)-4-(trifluoromethyl)-2-pyridinyl]thio]-N-cyclopropylacetamide IUPAC Name: 2-[3-cyano-6-(4-methylphenyl)-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-cyclopropylacetamide Traditional Name: 2-[[3-cyano-6-(p-tolyl)-4-(trifluoromethyl)-2-pyridyl]thio]-N-cyclopropyl-acetamide Formula: C19H16F3N3OS MolecularWeight: 391.41005

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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)NC3CC3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C(F)(F)F)C#N)SCC(=O)NC3CC3

InChI

InChI=1S/C19H16F3N3OS/c1-11-2-4-12(5-3-11)16-8-15(19(20,21)22)14(9-23)18(25-16)27-10-17(26)24-13-6-7-13/h2-5,8,13H,6-7,10H2,1H3,(H,24,26)