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

Systemtic Name: 4-(2,6-dimethylphenyl)-2,5-dimethyl-1,2,4-triazol-3-one Openeye Name: 4-(2,6-dimethylphenyl)-2,5-dimethyl-1,2,4-triazol-3-one CAS Name: 4-(2,6-dimethylphenyl)-2,5-dimethyl-1,2,4-triazol-3-one IUPAC Name: 4-(2,6-dimethylphenyl)-2,5-dimethyl-1,2,4-triazol-3-one Traditional Name: 4-(2,6-dimethylphenyl)-2,5-dimethyl-1,2,4-triazol-3-one Formula: C12H15N3O MolecularWeight: 217.267

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15N3O/c1-8-6-5-7-9(2)11(8)15-10(3)13-14(4)12(15)16/h5-7H,1-4H3