1-methyl-5-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-1,2,4-triazol-3-amine

Systemtic Name: 1-methyl-5-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-1,2,4-triazol-3-amine Openeye Name: 1-methyl-5-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-1,2,4-triazol-3-amine CAS Name: 1-methyl-5-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]-1,2,4-triazol-3-amine IUPAC Name: 1-methyl-5-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-1,2,4-triazol-3-amine Traditional Name: [1-methyl-5-[4-[3-(trifluoromethyl)phenyl]piperazino]-1,2,4-triazol-3-yl]amine Formula: C14H17F3N6 MolecularWeight: 326.32019

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC(=N1)N)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CN1C(=NC(=N1)N)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C14H17F3N6/c1-21-13(19-12(18)20-21)23-7-5-22(6-8-23)11-4-2-3-10(9-11)14(15,16)17/h2-4,9H,5-8H2,1H3,(H2,18,20)