N-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide

Systemtic Name: N-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide Openeye Name: N-[2-(1-piperidyl)-5-(trifluoromethyl)phenyl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide CAS Name: N-[2-(1-piperidinyl)-5-(trifluoromethyl)phenyl]-2-(1H-1,2,4-triazol-5-ylthio)acetamide IUPAC Name: N-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide Traditional Name: N-[2-piperidino-5-(trifluoromethyl)phenyl]-2-(1H-1,2,4-triazol-5-ylthio)acetamide Formula: C16H18F3N5OS MolecularWeight: 385.40723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)CSC3=NC=NN3

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)CSC3=NC=NN3

InChI

InChI=1S/C16H18F3N5OS/c17-16(18,19)11-4-5-13(24-6-2-1-3-7-24)12(8-11)22-14(25)9-26-15-20-10-21-23-15/h4-5,8,10H,1-3,6-7,9H2,(H,22,25)(H,20,21,23)