4-methyl-2-[(4-methylphenyl)methyl]-1,2,4-triazol-3-one

Systemtic Name: 4-methyl-2-[(4-methylphenyl)methyl]-1,2,4-triazol-3-one Openeye Name: 4-methyl-2-(p-tolylmethyl)-1,2,4-triazol-3-one CAS Name: 4-methyl-2-[(4-methylphenyl)methyl]-1,2,4-triazol-3-one IUPAC Name: 4-methyl-2-[(4-methylphenyl)methyl]-1,2,4-triazol-3-one Traditional Name: 4-methyl-2-(4-methylbenzyl)-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)CN2C(=O)N(C=N2)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=O)N(C=N2)C

InChI

InChI=1S/C11H13N3O/c1-9-3-5-10(6-4-9)7-14-11(15)13(2)8-12-14/h3-6,8H,7H2,1-2H3