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

Systemtic Name: 3-phenyl-4-[(E)-pyridin-4-ylmethylideneamino]-1H-1,2,4-triazol-5-one Openeye Name: 3-phenyl-4-[(E)-4-pyridylmethyleneamino]-1H-1,2,4-triazol-5-one CAS Name: 3-phenyl-4-[(E)-pyridin-4-ylmethylideneamino]-1H-1,2,4-triazol-5-one IUPAC Name: 3-phenyl-4-[(E)-pyridin-4-ylmethylideneamino]-1H-1,2,4-triazol-5-one Traditional Name: 3-phenyl-4-[(E)-4-pyridylmethyleneamino]-1H-1,2,4-triazol-5-one Formula: C14H11N5O MolecularWeight: 265.27004

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NNC(=O)N2N=CC3=CC=NC=C3

Isomeric SMILES

C1=CC=C(C=C1)C2=NNC(=O)N2/N=C/C3=CC=NC=C3

InChI

InChI=1S/C14H11N5O/c20-14-18-17-13(12-4-2-1-3-5-12)19(14)16-10-11-6-8-15-9-7-11/h1-10H,(H,18,20)/b16-10+