2-[3-cyano-6-ethyl-5-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(1-phenylethyl)ethanamide

Systemtic Name: 2-[3-cyano-6-ethyl-5-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(1-phenylethyl)ethanamide Openeye Name: 2-[[3-cyano-6-ethyl-5-methyl-4-(trifluoromethyl)-2-pyridyl]sulfanyl]-N-(1-phenylethyl)acetamide CAS Name: 2-[[3-cyano-6-ethyl-5-methyl-4-(trifluoromethyl)-2-pyridinyl]thio]-N-(1-phenylethyl)acetamide IUPAC Name: 2-[3-cyano-6-ethyl-5-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(1-phenylethyl)acetamide Traditional Name: 2-[[3-cyano-6-ethyl-5-methyl-4-(trifluoromethyl)-2-pyridyl]thio]-N-(1-phenylethyl)acetamide Formula: C20H20F3N3OS MolecularWeight: 407.45251

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C(=N1)SCC(=O)NC(C)C2=CC=CC=C2)C#N)C(F)(F)F)C

Isomeric SMILES

CCC1=C(C(=C(C(=N1)SCC(=O)NC(C)C2=CC=CC=C2)C#N)C(F)(F)F)C

InChI

InChI=1S/C20H20F3N3OS/c1-4-16-12(2)18(20(21,22)23)15(10-24)19(26-16)28-11-17(27)25-13(3)14-8-6-5-7-9-14/h5-9,13H,4,11H2,1-3H3,(H,25,27)