2-(cyclopropylmethyl)-5-methyl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-one

Systemtic Name: 2-(cyclopropylmethyl)-5-methyl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-one Openeye Name: 2-(cyclopropylmethyl)-5-methyl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-one CAS Name: 2-(cyclopropylmethyl)-5-methyl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-one IUPAC Name: 2-(cyclopropylmethyl)-5-methyl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-one Traditional Name: 2-(cyclopropylmethyl)-5-methyl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-one Formula: C14H14F3N3O MolecularWeight: 297.27567

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)CC3CC3

Isomeric SMILES

CC1=NN(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)CC3CC3

InChI

InChI=1S/C14H14F3N3O/c1-9-18-19(8-10-5-6-10)13(21)20(9)12-4-2-3-11(7-12)14(15,16)17/h2-4,7,10H,5-6,8H2,1H3