2-(1H-1,2,4-triazol-5-ylsulfanyl)-N-[3-(trifluoromethyl)phenyl]propanamide

Systemtic Name: 2-(1H-1,2,4-triazol-5-ylsulfanyl)-N-[3-(trifluoromethyl)phenyl]propanamide Openeye Name: 2-(1H-1,2,4-triazol-5-ylsulfanyl)-N-[3-(trifluoromethyl)phenyl]propanamide CAS Name: 2-(1H-1,2,4-triazol-5-ylthio)-N-[3-(trifluoromethyl)phenyl]propanamide IUPAC Name: 2-(1H-1,2,4-triazol-5-ylsulfanyl)-N-[3-(trifluoromethyl)phenyl]propanamide Traditional Name: 2-(1H-1,2,4-triazol-5-ylthio)-N-[3-(trifluoromethyl)phenyl]propionamide Formula: C12H11F3N4OS MolecularWeight: 316.30215

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C(F)(F)F)SC2=NC=NN2

Isomeric SMILES

CC(C(=O)NC1=CC=CC(=C1)C(F)(F)F)SC2=NC=NN2

InChI

InChI=1S/C12H11F3N4OS/c1-7(21-11-16-6-17-19-11)10(20)18-9-4-2-3-8(5-9)12(13,14)15/h2-7H,1H3,(H,18,20)(H,16,17,19)