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

Systemtic Name: 4-[4-(3-methoxyphenyl)piperazin-1-yl]-N-(pyridin-3-ylmethyl)phthalazine-1-carboxamide Openeye Name: 4-[4-(3-methoxyphenyl)piperazin-1-yl]-N-(3-pyridylmethyl)phthalazine-1-carboxamide CAS Name: 4-[4-(3-methoxyphenyl)-1-piperazinyl]-N-(3-pyridinylmethyl)-1-phthalazinecarboxamide IUPAC Name: 4-[4-(3-methoxyphenyl)piperazin-1-yl]-N-(pyridin-3-ylmethyl)phthalazine-1-carboxamide Traditional Name: 4-[4-(3-methoxyphenyl)piperazino]-N-(3-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=CN=CC=C5

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C3=NN=C(C4=CC=CC=C43)C(=O)NCC5=CN=CC=C5

InChI

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