2-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]-6-(3,4,5-trimethoxyphenyl)pyridazin-3-one

Systemtic Name: 2-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]-6-(3,4,5-trimethoxyphenyl)pyridazin-3-one Openeye Name: 2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-6-(3,4,5-trimethoxyphenyl)pyridazin-3-one CAS Name: 2-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-6-(3,4,5-trimethoxyphenyl)-3-pyridazinone IUPAC Name: 2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-6-(3,4,5-trimethoxyphenyl)pyridazin-3-one Traditional Name: 2-[2-keto-2-(4-phenylpiperazino)ethyl]-6-(3,4,5-trimethoxyphenyl)pyridazin-3-one Formula: C25H28N4O5 MolecularWeight: 464.51362

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NN(C(=O)C=C2)CC(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NN(C(=O)C=C2)CC(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C25H28N4O5/c1-32-21-15-18(16-22(33-2)25(21)34-3)20-9-10-23(30)29(26-20)17-24(31)28-13-11-27(12-14-28)19-7-5-4-6-8-19/h4-10,15-16H,11-14,17H2,1-3H3