3-(3,4-dimethoxyphenyl)-N-[2-[3-(4-methylpiperazin-1-yl)propylamino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-(3,4-dimethoxyphenyl)-N-[2-[3-(4-methylpiperazin-1-yl)propylamino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-(3,4-dimethoxyphenyl)-N-[2-[3-(4-methylpiperazin-1-yl)propylamino]-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-(3,4-dimethoxyphenyl)-N-[2-[3-(4-methyl-1-piperazinyl)propylamino]-2-oxoethyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-(3,4-dimethoxyphenyl)-N-[2-[3-(4-methylpiperazin-1-yl)propylamino]-2-oxoethyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-(3,4-dimethoxyphenyl)-4-keto-N-[2-keto-2-[3-(4-methylpiperazino)propylamino]ethyl]phthalazine-1-carboxamide Formula: C27H34N6O5 MolecularWeight: 522.59606

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCNC(=O)CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CN1CCN(CC1)CCCNC(=O)CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C27H34N6O5/c1-31-13-15-32(16-14-31)12-6-11-28-24(34)18-29-26(35)25-20-7-4-5-8-21(20)27(36)33(30-25)19-9-10-22(37-2)23(17-19)38-3/h4-5,7-10,17H,6,11-16,18H2,1-3H3,(H,28,34)(H,29,35)