4-methyl-3-(trifluoromethyl)-1H-1,2,4-triazol-5-one; 1,2,4-triazol-3-one

Systemtic Name: 4-methyl-3-(trifluoromethyl)-1H-1,2,4-triazol-5-one; 1,2,4-triazol-3-one Openeye Name: 4-methyl-3-(trifluoromethyl)-1H-1,2,4-triazol-5-one; 1,2,4-triazol-3-one CAS Name: 4-methyl-3-(trifluoromethyl)-1H-1,2,4-triazol-5-one; 1,2,4-triazol-3-one IUPAC Name: 4-methyl-3-(trifluoromethyl)-1H-1,2,4-triazol-5-one; 1,2,4-triazol-3-one Traditional Name: 4-methyl-3-(trifluoromethyl)-1H-1,2,4-triazol-5-one; 1,2,4-triazol-3-one Formula: C6H5F3N6O2 MolecularWeight: 250.13811

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NNC1=O)C(F)(F)F.C1=NC(=O)N=N1

Isomeric SMILES

CN1C(=NNC1=O)C(F)(F)F.C1=NC(=O)N=N1

InChI

InChI=1S/C4H4F3N3O.C2HN3O/c1-10-2(4(5,6)7)8-9-3(10)11;6-2-3-1-4-5-2/h1H3,(H,9,11);1H