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

Systemtic Name: 4-methyl-2-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]phthalazin-1-one Openeye Name: 4-methyl-2-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]phthalazin-1-one CAS Name: 4-methyl-2-[2-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl]-1-phthalazinone IUPAC Name: 4-methyl-2-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]phthalazin-1-one Traditional Name: 2-[2-keto-2-[4-(2-pyrimidyl)piperazino]ethyl]-4-methyl-phthalazin-1-one Formula: C19H20N6O2 MolecularWeight: 364.4011

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C2=CC=CC=C12)CC(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CC1=NN(C(=O)C2=CC=CC=C12)CC(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C19H20N6O2/c1-14-15-5-2-3-6-16(15)18(27)25(22-14)13-17(26)23-9-11-24(12-10-23)19-20-7-4-8-21-19/h2-8H,9-13H2,1H3