3-cyclopropyl-4-[[3-(trifluoromethyl)phenyl]methyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-cyclopropyl-4-[[3-(trifluoromethyl)phenyl]methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 3-cyclopropyl-4-[[3-(trifluoromethyl)phenyl]methyl]-1H-1,2,4-triazole-5-thione CAS Name: 3-cyclopropyl-4-[[3-(trifluoromethyl)phenyl]methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-cyclopropyl-4-[[3-(trifluoromethyl)phenyl]methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 3-cyclopropyl-4-[3-(trifluoromethyl)benzyl]-1H-1,2,4-triazole-5-thione Formula: C13H12F3N3S MolecularWeight: 299.31469

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NNC(=S)N2CC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1CC1C2=NNC(=S)N2CC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C13H12F3N3S/c14-13(15,16)10-3-1-2-8(6-10)7-19-11(9-4-5-9)17-18-12(19)20/h1-3,6,9H,4-5,7H2,(H,18,20)