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

Systemtic Name: N-(2-cyanoethyl)-2-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-phenyl-propanamide Openeye Name: N-(2-cyanoethyl)-2-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridyl]sulfanyl]-N-phenyl-propanamide CAS Name: N-(2-cyanoethyl)-2-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridinyl]thio]-N-phenylpropanamide IUPAC Name: N-(2-cyanoethyl)-2-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-phenylpropanamide Traditional Name: N-(2-cyanoethyl)-2-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridyl]thio]-N-phenyl-propionamide Formula: C20H17F3N4OS MolecularWeight: 418.43539

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)C(F)(F)F)C#N)SC(C)C(=O)N(CCC#N)C2=CC=CC=C2

Isomeric SMILES

CC1=NC(=C(C(=C1)C(F)(F)F)C#N)SC(C)C(=O)N(CCC#N)C2=CC=CC=C2

InChI

InChI=1S/C20H17F3N4OS/c1-13-11-17(20(21,22)23)16(12-25)18(26-13)29-14(2)19(28)27(10-6-9-24)15-7-4-3-5-8-15/h3-5,7-8,11,14H,6,10H2,1-2H3