2-[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(2,3-dimethylphenyl)ethanamide

Systemtic Name: 2-[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(2,3-dimethylphenyl)ethanamide Openeye Name: 2-[[3-cyano-6-(2-thienyl)-4-(trifluoromethyl)-2-pyridyl]sulfanyl]-N-(2,3-dimethylphenyl)acetamide CAS Name: 2-[[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)-2-pyridinyl]thio]-N-(2,3-dimethylphenyl)acetamide IUPAC Name: 2-[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(2,3-dimethylphenyl)acetamide Traditional Name: 2-[[3-cyano-6-(2-thienyl)-4-(trifluoromethyl)-2-pyridyl]thio]-N-(2,3-dimethylphenyl)acetamide Formula: C21H16F3N3OS2 MolecularWeight: 447.49645

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)CSC2=C(C(=CC(=N2)C3=CC=CS3)C(F)(F)F)C#N)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)CSC2=C(C(=CC(=N2)C3=CC=CS3)C(F)(F)F)C#N)C

InChI

InChI=1S/C21H16F3N3OS2/c1-12-5-3-6-16(13(12)2)26-19(28)11-30-20-14(10-25)15(21(22,23)24)9-17(27-20)18-7-4-8-29-18/h3-9H,11H2,1-2H3,(H,26,28)