N-[2-(4-methylpiperazin-1-yl)ethyl]-2-[1-oxidanylidene-4-(pyridin-4-ylmethyl)phthalazin-2-yl]ethanamide

Systemtic Name: N-[2-(4-methylpiperazin-1-yl)ethyl]-2-[1-oxidanylidene-4-(pyridin-4-ylmethyl)phthalazin-2-yl]ethanamide Openeye Name: N-[2-(4-methylpiperazin-1-yl)ethyl]-2-[1-oxo-4-(4-pyridylmethyl)phthalazin-2-yl]acetamide CAS Name: N-[2-(4-methyl-1-piperazinyl)ethyl]-2-[1-oxo-4-(pyridin-4-ylmethyl)-2-phthalazinyl]acetamide IUPAC Name: N-[2-(4-methylpiperazin-1-yl)ethyl]-2-[1-oxo-4-(pyridin-4-ylmethyl)phthalazin-2-yl]acetamide Traditional Name: 2-[1-keto-4-(4-pyridylmethyl)phthalazin-2-yl]-N-[2-(4-methylpiperazino)ethyl]acetamide Formula: C23H28N6O2 MolecularWeight: 420.50742

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCNC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)CC4=CC=NC=C4

Isomeric SMILES

CN1CCN(CC1)CCNC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)CC4=CC=NC=C4

InChI

InChI=1S/C23H28N6O2/c1-27-12-14-28(15-13-27)11-10-25-22(30)17-29-23(31)20-5-3-2-4-19(20)21(26-29)16-18-6-8-24-9-7-18/h2-9H,10-17H2,1H3,(H,25,30)