4-[4-(3-methoxyphenyl)piperazin-1-yl]-N-pyridin-3-yl-phthalazine-1-carboxamide

Systemtic Name: 4-[4-(3-methoxyphenyl)piperazin-1-yl]-N-pyridin-3-yl-phthalazine-1-carboxamide Openeye Name: 4-[4-(3-methoxyphenyl)piperazin-1-yl]-N-(3-pyridyl)phthalazine-1-carboxamide CAS Name: 4-[4-(3-methoxyphenyl)-1-piperazinyl]-N-(3-pyridinyl)-1-phthalazinecarboxamide IUPAC Name: 4-[4-(3-methoxyphenyl)piperazin-1-yl]-N-pyridin-3-ylphthalazine-1-carboxamide Traditional Name: 4-[4-(3-methoxyphenyl)piperazino]-N-(3-pyridyl)phthalazine-1-carboxamide Formula: C25H24N6O2 MolecularWeight: 440.49706

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C3=NN=C(C4=CC=CC=C43)C(=O)NC5=CN=CC=C5

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C3=NN=C(C4=CC=CC=C43)C(=O)NC5=CN=CC=C5

InChI

InChI=1S/C25H24N6O2/c1-33-20-8-4-7-19(16-20)30-12-14-31(15-13-30)24-22-10-3-2-9-21(22)23(28-29-24)25(32)27-18-6-5-11-26-17-18/h2-11,16-17H,12-15H2,1H3,(H,27,32)