1-(5-cyanopyridin-2-yl)-N-[4-(trifluoromethylsulfanyl)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-(5-cyanopyridin-2-yl)-N-[4-(trifluoromethylsulfanyl)phenyl]piperidine-4-carboxamide Openeye Name: 1-(5-cyano-2-pyridyl)-N-[4-(trifluoromethylsulfanyl)phenyl]piperidine-4-carboxamide CAS Name: 1-(5-cyano-2-pyridinyl)-N-[4-(trifluoromethylthio)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(5-cyanopyridin-2-yl)-N-[4-(trifluoromethylsulfanyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-(5-cyano-2-pyridyl)-N-[4-(trifluoromethylthio)phenyl]isonipecotamide Formula: C19H17F3N4OS MolecularWeight: 406.42469

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=C(C=C2)SC(F)(F)F)C3=NC=C(C=C3)C#N

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=C(C=C2)SC(F)(F)F)C3=NC=C(C=C3)C#N

InChI

InChI=1S/C19H17F3N4OS/c20-19(21,22)28-16-4-2-15(3-5-16)25-18(27)14-7-9-26(10-8-14)17-6-1-13(11-23)12-24-17/h1-6,12,14H,7-10H2,(H,25,27)