4-azanyl-5-[(4-methylphenyl)methyl]-2-(phenylcarbonyl)-1,2,4-triazol-3-one

Systemtic Name: 4-azanyl-5-[(4-methylphenyl)methyl]-2-(phenylcarbonyl)-1,2,4-triazol-3-one Openeye Name: 4-amino-2-benzoyl-5-(p-tolylmethyl)-1,2,4-triazol-3-one CAS Name: 4-amino-2-benzoyl-5-[(4-methylphenyl)methyl]-1,2,4-triazol-3-one IUPAC Name: 4-amino-2-benzoyl-5-[(4-methylphenyl)methyl]-1,2,4-triazol-3-one Traditional Name: 4-amino-2-benzoyl-5-(4-methylbenzyl)-1,2,4-triazol-3-one Formula: C17H16N4O2 MolecularWeight: 308.33454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=NN(C(=O)N2N)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)CC2=NN(C(=O)N2N)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H16N4O2/c1-12-7-9-13(10-8-12)11-15-19-21(17(23)20(15)18)16(22)14-5-3-2-4-6-14/h2-10H,11,18H2,1H3