2-(2,4-dimethoxyphenyl)-4-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-phthalazin-1-one

Systemtic Name: 2-(2,4-dimethoxyphenyl)-4-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-phthalazin-1-one Openeye Name: 2-(2,4-dimethoxyphenyl)-4-[4-(2-pyridyl)piperazine-1-carbonyl]phthalazin-1-one CAS Name: 2-(2,4-dimethoxyphenyl)-4-[oxo-[4-(2-pyridinyl)-1-piperazinyl]methyl]-1-phthalazinone IUPAC Name: 2-(2,4-dimethoxyphenyl)-4-(4-pyridin-2-ylpiperazine-1-carbonyl)phthalazin-1-one Traditional Name: 2-(2,4-dimethoxyphenyl)-4-[4-(2-pyridyl)piperazine-1-carbonyl]phthalazin-1-one Formula: C26H25N5O4 MolecularWeight: 471.5078

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)N4CCN(CC4)C5=CC=CC=N5)OC

Isomeric SMILES

COC1=CC(=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)N4CCN(CC4)C5=CC=CC=N5)OC

InChI

InChI=1S/C26H25N5O4/c1-34-18-10-11-21(22(17-18)35-2)31-25(32)20-8-4-3-7-19(20)24(28-31)26(33)30-15-13-29(14-16-30)23-9-5-6-12-27-23/h3-12,17H,13-16H2,1-2H3