4-methyl-2-[2-oxidanylidene-2-[4-(pyridin-2-ylmethyl)piperazin-1-yl]ethyl]phthalazin-1-one

Systemtic Name: 4-methyl-2-[2-oxidanylidene-2-[4-(pyridin-2-ylmethyl)piperazin-1-yl]ethyl]phthalazin-1-one Openeye Name: 4-methyl-2-[2-oxo-2-[4-(2-pyridylmethyl)piperazin-1-yl]ethyl]phthalazin-1-one CAS Name: 4-methyl-2-[2-oxo-2-[4-(2-pyridinylmethyl)-1-piperazinyl]ethyl]-1-phthalazinone IUPAC Name: 4-methyl-2-[2-oxo-2-[4-(pyridin-2-ylmethyl)piperazin-1-yl]ethyl]phthalazin-1-one Traditional Name: 2-[2-keto-2-[4-(2-pyridylmethyl)piperazino]ethyl]-4-methyl-phthalazin-1-one Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C2=CC=CC=C12)CC(=O)N3CCN(CC3)CC4=CC=CC=N4

Isomeric SMILES

CC1=NN(C(=O)C2=CC=CC=C12)CC(=O)N3CCN(CC3)CC4=CC=CC=N4

InChI

InChI=1S/C21H23N5O2/c1-16-18-7-2-3-8-19(18)21(28)26(23-16)15-20(27)25-12-10-24(11-13-25)14-17-6-4-5-9-22-17/h2-9H,10-15H2,1H3