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

Systemtic Name: 2-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(4-cyanophenyl)propanamide Openeye Name: 2-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridyl]sulfanyl]-N-(4-cyanophenyl)propanamide CAS Name: 2-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridinyl]thio]-N-(4-cyanophenyl)propanamide IUPAC Name: 2-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(4-cyanophenyl)propanamide Traditional Name: 2-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridyl]thio]-N-(4-cyanophenyl)propionamide Formula: C18H13F3N4OS MolecularWeight: 390.38223

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)NC2=CC=C(C=C2)C#N

Isomeric SMILES

CC1=NC(=C(C(=C1)C(F)(F)F)C#N)SC(C)C(=O)NC2=CC=C(C=C2)C#N

InChI

InChI=1S/C18H13F3N4OS/c1-10-7-15(18(19,20)21)14(9-23)17(24-10)27-11(2)16(26)25-13-5-3-12(8-22)4-6-13/h3-7,11H,1-2H3,(H,25,26)