2-[2-oxidanylidene-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-4-(pyridin-3-ylmethyl)phthalazin-1-one

Systemtic Name: 2-[2-oxidanylidene-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-4-(pyridin-3-ylmethyl)phthalazin-1-one Openeye Name: 2-[2-oxo-2-[4-(2-pyridyl)piperazin-1-yl]ethyl]-4-(3-pyridylmethyl)phthalazin-1-one CAS Name: 2-[2-oxo-2-[4-(2-pyridinyl)-1-piperazinyl]ethyl]-4-(3-pyridinylmethyl)-1-phthalazinone IUPAC Name: 2-[2-oxo-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-4-(pyridin-3-ylmethyl)phthalazin-1-one Traditional Name: 2-[2-keto-2-[4-(2-pyridyl)piperazino]ethyl]-4-(3-pyridylmethyl)phthalazin-1-one Formula: C25H24N6O2 MolecularWeight: 440.49706

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=O)CN3C(=O)C4=CC=CC=C4C(=N3)CC5=CN=CC=C5

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=O)CN3C(=O)C4=CC=CC=C4C(=N3)CC5=CN=CC=C5

InChI

InChI=1S/C25H24N6O2/c32-24(30-14-12-29(13-15-30)23-9-3-4-11-27-23)18-31-25(33)21-8-2-1-7-20(21)22(28-31)16-19-6-5-10-26-17-19/h1-11,17H,12-16,18H2