3-(phenylmethyl)-4-[(E)-pyridin-2-ylmethylideneamino]-1H-1,2,4-triazol-5-one

Systemtic Name: 3-(phenylmethyl)-4-[(E)-pyridin-2-ylmethylideneamino]-1H-1,2,4-triazol-5-one Openeye Name: 3-benzyl-4-[(E)-2-pyridylmethyleneamino]-1H-1,2,4-triazol-5-one CAS Name: 3-(phenylmethyl)-4-[(E)-2-pyridinylmethylideneamino]-1H-1,2,4-triazol-5-one IUPAC Name: 3-benzyl-4-[(E)-pyridin-2-ylmethylideneamino]-1H-1,2,4-triazol-5-one Traditional Name: 3-benzyl-4-[(E)-2-pyridylmethyleneamino]-1H-1,2,4-triazol-5-one Formula: C15H13N5O MolecularWeight: 279.29662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NNC(=O)N2N=CC3=CC=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)CC2=NNC(=O)N2/N=C/C3=CC=CC=N3

InChI

InChI=1S/C15H13N5O/c21-15-19-18-14(10-12-6-2-1-3-7-12)20(15)17-11-13-8-4-5-9-16-13/h1-9,11H,10H2,(H,19,21)/b17-11+