4-[4-(3-methoxyphenyl)piperazin-1-yl]-N-(pyridin-2-ylmethyl)phthalazine-1-carboxamide

Systemtic Name: 4-[4-(3-methoxyphenyl)piperazin-1-yl]-N-(pyridin-2-ylmethyl)phthalazine-1-carboxamide Openeye Name: 4-[4-(3-methoxyphenyl)piperazin-1-yl]-N-(2-pyridylmethyl)phthalazine-1-carboxamide CAS Name: 4-[4-(3-methoxyphenyl)-1-piperazinyl]-N-(2-pyridinylmethyl)-1-phthalazinecarboxamide IUPAC Name: 4-[4-(3-methoxyphenyl)piperazin-1-yl]-N-(pyridin-2-ylmethyl)phthalazine-1-carboxamide Traditional Name: 4-[4-(3-methoxyphenyl)piperazino]-N-(2-pyridylmethyl)phthalazine-1-carboxamide Formula: C26H26N6O2 MolecularWeight: 454.52364

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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)NCC5=CC=CC=N5

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C3=NN=C(C4=CC=CC=C43)C(=O)NCC5=CC=CC=N5

InChI

InChI=1S/C26H26N6O2/c1-34-21-9-6-8-20(17-21)31-13-15-32(16-14-31)25-23-11-3-2-10-22(23)24(29-30-25)26(33)28-18-19-7-4-5-12-27-19/h2-12,17H,13-16,18H2,1H3,(H,28,33)