6-(3,4-dimethoxyphenyl)-2-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]pyridazin-3-one

Systemtic Name: 6-(3,4-dimethoxyphenyl)-2-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]pyridazin-3-one Openeye Name: 6-(3,4-dimethoxyphenyl)-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]pyridazin-3-one CAS Name: 6-(3,4-dimethoxyphenyl)-2-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3-pyridazinone IUPAC Name: 6-(3,4-dimethoxyphenyl)-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]pyridazin-3-one Traditional Name: 6-(3,4-dimethoxyphenyl)-2-[2-keto-2-(4-phenylpiperazino)ethyl]pyridazin-3-one Formula: C24H26N4O4 MolecularWeight: 434.48764

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C(=O)C=C2)CC(=O)N3CCN(CC3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C(=O)C=C2)CC(=O)N3CCN(CC3)C4=CC=CC=C4)OC

InChI

InChI=1S/C24H26N4O4/c1-31-21-10-8-18(16-22(21)32-2)20-9-11-23(29)28(25-20)17-24(30)27-14-12-26(13-15-27)19-6-4-3-5-7-19/h3-11,16H,12-15,17H2,1-2H3