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

Systemtic Name: 2-methyl-5-(4-methylphenyl)-1H-1,2,4-triazol-3-one Openeye Name: 2-methyl-5-(p-tolyl)-1H-1,2,4-triazol-3-one CAS Name: 2-methyl-5-(4-methylphenyl)-1H-1,2,4-triazol-3-one IUPAC Name: 2-methyl-5-(4-methylphenyl)-1H-1,2,4-triazol-3-one Traditional Name: 2-methyl-5-(p-tolyl)-1H-1,2,4-triazol-3-one Formula: C10H11N3O MolecularWeight: 189.21384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=O)N(N2)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=O)N(N2)C

InChI

InChI=1S/C10H11N3O/c1-7-3-5-8(6-4-7)9-11-10(14)13(2)12-9/h3-6H,1-2H3,(H,11,12,14)