6,7-dimethoxy-4-[2-(1-oxidanylidene-4-pyridin-3-yl-phthalazin-2-yl)pyridin-3-yl]-2-(pyridin-4-ylmethyl)phthalazin-1-one

Systemtic Name: 6,7-dimethoxy-4-[2-(1-oxidanylidene-4-pyridin-3-yl-phthalazin-2-yl)pyridin-3-yl]-2-(pyridin-4-ylmethyl)phthalazin-1-one Openeye Name: 6,7-dimethoxy-4-[2-[1-oxo-4-(3-pyridyl)phthalazin-2-yl]-3-pyridyl]-2-(4-pyridylmethyl)phthalazin-1-one CAS Name: 6,7-dimethoxy-4-[2-[1-oxo-4-(3-pyridinyl)-2-phthalazinyl]-3-pyridinyl]-2-(pyridin-4-ylmethyl)-1-phthalazinone IUPAC Name: 6,7-dimethoxy-4-[2-(1-oxo-4-pyridin-3-ylphthalazin-2-yl)pyridin-3-yl]-2-(pyridin-4-ylmethyl)phthalazin-1-one Traditional Name: 4-[2-[1-keto-4-(3-pyridyl)phthalazin-2-yl]-3-pyridyl]-6,7-dimethoxy-2-(4-pyridylmethyl)phthalazin-1-one Formula: C34H25N7O4 MolecularWeight: 595.6068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NN(C2=O)CC3=CC=NC=C3)C4=C(N=CC=C4)N5C(=O)C6=CC=CC=C6C(=N5)C7=CN=CC=C7)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NN(C2=O)CC3=CC=NC=C3)C4=C(N=CC=C4)N5C(=O)C6=CC=CC=C6C(=N5)C7=CN=CC=C7)OC

InChI

InChI=1S/C34H25N7O4/c1-44-28-17-26-27(18-29(28)45-2)33(42)40(20-21-11-15-35-16-12-21)38-31(26)25-10-6-14-37-32(25)41-34(43)24-9-4-3-8-23(24)30(39-41)22-7-5-13-36-19-22/h3-19H,20H2,1-2H3