4-(methylamino)-5-phenyl-2-(phenylmethyl)-1,2,4-triazol-3-one

Systemtic Name: 4-(methylamino)-5-phenyl-2-(phenylmethyl)-1,2,4-triazol-3-one Openeye Name: 2-benzyl-4-(methylamino)-5-phenyl-1,2,4-triazol-3-one CAS Name: 4-(methylamino)-5-phenyl-2-(phenylmethyl)-1,2,4-triazol-3-one IUPAC Name: 2-benzyl-4-(methylamino)-5-phenyl-1,2,4-triazol-3-one Traditional Name: 2-benzyl-4-(methylamino)-5-phenyl-1,2,4-triazol-3-one Formula: C16H16N4O MolecularWeight: 280.32444

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Descriptors Computed from Structure

Canonical SMILES:

CNN1C(=NN(C1=O)CC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CNN1C(=NN(C1=O)CC2=CC=CC=C2)C3=CC=CC=C3

InChI

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