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

Systemtic Name: 2-[3-cyano-4-methyl-6-(trifluoromethyl)pyridin-2-yl]sulfanyl-N,N-diphenyl-ethanamide Openeye Name: 2-[[3-cyano-4-methyl-6-(trifluoromethyl)-2-pyridyl]sulfanyl]-N,N-diphenyl-acetamide CAS Name: 2-[[3-cyano-4-methyl-6-(trifluoromethyl)-2-pyridinyl]thio]-N,N-diphenylacetamide IUPAC Name: 2-[3-cyano-4-methyl-6-(trifluoromethyl)pyridin-2-yl]sulfanyl-N,N-diphenylacetamide Traditional Name: 2-[[3-cyano-4-methyl-6-(trifluoromethyl)-2-pyridyl]thio]-N,N-diphenyl-acetamide Formula: C22H16F3N3OS MolecularWeight: 427.44215

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCC(=O)N(C2=CC=CC=C2)C3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SCC(=O)N(C2=CC=CC=C2)C3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C22H16F3N3OS/c1-15-12-19(22(23,24)25)27-21(18(15)13-26)30-14-20(29)28(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-12H,14H2,1H3