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

Systemtic Name: 3-(4-methoxyphenyl)-N-[2-[3-(4-methylpiperazin-1-yl)propylamino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-(4-methoxyphenyl)-N-[2-[3-(4-methylpiperazin-1-yl)propylamino]-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-(4-methoxyphenyl)-N-[2-[3-(4-methyl-1-piperazinyl)propylamino]-2-oxoethyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-(4-methoxyphenyl)-N-[2-[3-(4-methylpiperazin-1-yl)propylamino]-2-oxoethyl]-4-oxophthalazine-1-carboxamide Traditional Name: 4-keto-N-[2-keto-2-[3-(4-methylpiperazino)propylamino]ethyl]-3-(4-methoxyphenyl)phthalazine-1-carboxamide Formula: C26H32N6O4 MolecularWeight: 492.57008

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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

Isomeric SMILES

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

InChI

InChI=1S/C26H32N6O4/c1-30-14-16-31(17-15-30)13-5-12-27-23(33)18-28-25(34)24-21-6-3-4-7-22(21)26(35)32(29-24)19-8-10-20(36-2)11-9-19/h3-4,6-11H,5,12-18H2,1-2H3,(H,27,33)(H,28,34)