4-(2,6-dimethylphenyl)-5-methyl-2-(phenylmethyl)-1,2,4-triazol-3-one

Systemtic Name: 4-(2,6-dimethylphenyl)-5-methyl-2-(phenylmethyl)-1,2,4-triazol-3-one Openeye Name: 2-benzyl-4-(2,6-dimethylphenyl)-5-methyl-1,2,4-triazol-3-one CAS Name: 4-(2,6-dimethylphenyl)-5-methyl-2-(phenylmethyl)-1,2,4-triazol-3-one IUPAC Name: 2-benzyl-4-(2,6-dimethylphenyl)-5-methyl-1,2,4-triazol-3-one Traditional Name: 2-benzyl-4-(2,6-dimethylphenyl)-5-methyl-1,2,4-triazol-3-one Formula: C18H19N3O MolecularWeight: 293.36296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C(=NN(C2=O)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=NN(C2=O)CC3=CC=CC=C3)C

InChI

InChI=1S/C18H19N3O/c1-13-8-7-9-14(2)17(13)21-15(3)19-20(18(21)22)12-16-10-5-4-6-11-16/h4-11H,12H2,1-3H3