4-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]-2H-phthalazin-1-one

Systemtic Name: 4-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]-2H-phthalazin-1-one Openeye Name: 4-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]-2H-phthalazin-1-one CAS Name: 4-[2-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl]-2H-phthalazin-1-one IUPAC Name: 4-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]-2H-phthalazin-1-one Traditional Name: 4-[2-keto-2-[4-(2-pyrimidyl)piperazino]ethyl]-2H-phthalazin-1-one Formula: C18H18N6O2 MolecularWeight: 350.37452

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)CC3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)CC3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C18H18N6O2/c25-16(12-15-13-4-1-2-5-14(13)17(26)22-21-15)23-8-10-24(11-9-23)18-19-6-3-7-20-18/h1-7H,8-12H2,(H,22,26)