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

Systemtic Name: 2,5-dimethyl-4-(4-methylphenyl)-1,2,4-triazol-3-one Openeye Name: 2,5-dimethyl-4-(p-tolyl)-1,2,4-triazol-3-one CAS Name: 2,5-dimethyl-4-(4-methylphenyl)-1,2,4-triazol-3-one IUPAC Name: 2,5-dimethyl-4-(4-methylphenyl)-1,2,4-triazol-3-one Traditional Name: 2,5-dimethyl-4-(p-tolyl)-1,2,4-triazol-3-one Formula: C11H13N3O MolecularWeight: 203.24042

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13N3O/c1-8-4-6-10(7-5-8)14-9(2)12-13(3)11(14)15/h4-7H,1-3H3