5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-amine

Systemtic Name: 5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-amine Openeye Name: 5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-amine CAS Name: 5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-amine IUPAC Name: 5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-amine Traditional Name: [5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-yl]amine Formula: C9H7F3N4 MolecularWeight: 228.17389

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC(=NN2)N)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C2=NC(=NN2)N)C(F)(F)F

InChI

InChI=1S/C9H7F3N4/c10-9(11,12)6-3-1-5(2-4-6)7-14-8(13)16-15-7/h1-4H,(H3,13,14,15,16)