3-[6-(phenylmethyl)-[1,2,4]triazolo[3,4-a]phthalazin-3-yl]-1H-pyridazin-6-one

Systemtic Name: 3-[6-(phenylmethyl)-[1,2,4]triazolo[3,4-a]phthalazin-3-yl]-1H-pyridazin-6-one Openeye Name: 3-(6-benzyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)-1H-pyridazin-6-one CAS Name: 3-[6-(phenylmethyl)-[1,2,4]triazolo[3,4-a]phthalazin-3-yl]-1H-pyridazin-6-one IUPAC Name: 3-(6-benzyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)-1H-pyridazin-6-one Traditional Name: 3-(6-benzyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)-1H-pyridazin-6-one Formula: C20H14N6O MolecularWeight: 354.36476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NN3C(=NN=C3C4=CC=CC=C42)C5=NNC(=O)C=C5

Isomeric SMILES

C1=CC=C(C=C1)CC2=NN3C(=NN=C3C4=CC=CC=C42)C5=NNC(=O)C=C5

InChI

InChI=1S/C20H14N6O/c27-18-11-10-16(21-22-18)20-24-23-19-15-9-5-4-8-14(15)17(25-26(19)20)12-13-6-2-1-3-7-13/h1-11H,12H2,(H,22,27)