N-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]methyl]-2-(1-oxidanylidenephthalazin-2-yl)ethanamide

Systemtic Name: N-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]methyl]-2-(1-oxidanylidenephthalazin-2-yl)ethanamide Openeye Name: N-[[6-(4-methylpiperazin-1-yl)-3-pyridyl]methyl]-2-(1-oxophthalazin-2-yl)acetamide CAS Name: N-[[6-(4-methyl-1-piperazinyl)-3-pyridinyl]methyl]-2-(1-oxo-2-phthalazinyl)acetamide IUPAC Name: N-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]methyl]-2-(1-oxophthalazin-2-yl)acetamide Traditional Name: 2-(1-ketophthalazin-2-yl)-N-[[6-(4-methylpiperazino)-3-pyridyl]methyl]acetamide Formula: C21H24N6O2 MolecularWeight: 392.45426

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC=C(C=C2)CNC(=O)CN3C(=O)C4=CC=CC=C4C=N3

Isomeric SMILES

CN1CCN(CC1)C2=NC=C(C=C2)CNC(=O)CN3C(=O)C4=CC=CC=C4C=N3

InChI

InChI=1S/C21H24N6O2/c1-25-8-10-26(11-9-25)19-7-6-16(12-22-19)13-23-20(28)15-27-21(29)18-5-3-2-4-17(18)14-24-27/h2-7,12,14H,8-11,13,15H2,1H3,(H,23,28)