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

Systemtic Name: 3-[(4-methylphenyl)methyl]-4-phenylazanyl-1H-1,2,4-triazol-5-one Openeye Name: 4-anilino-3-(p-tolylmethyl)-1H-1,2,4-triazol-5-one CAS Name: 4-anilino-3-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-5-one IUPAC Name: 4-anilino-3-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-5-one Traditional Name: 4-anilino-3-(4-methylbenzyl)-1H-1,2,4-triazol-5-one Formula: C16H16N4O MolecularWeight: 280.32444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=NNC(=O)N2NC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)CC2=NNC(=O)N2NC3=CC=CC=C3

InChI

InChI=1S/C16H16N4O/c1-12-7-9-13(10-8-12)11-15-17-18-16(21)20(15)19-14-5-3-2-4-6-14/h2-10,19H,11H2,1H3,(H,18,21)