6-(4-bromophenyl)-2-[4-[4-(2-methoxyphenyl)piperazin-1-yl]-4-oxidanylidene-butyl]pyridazin-3-one

Systemtic Name: 6-(4-bromophenyl)-2-[4-[4-(2-methoxyphenyl)piperazin-1-yl]-4-oxidanylidene-butyl]pyridazin-3-one Openeye Name: 6-(4-bromophenyl)-2-[4-[4-(2-methoxyphenyl)piperazin-1-yl]-4-oxo-butyl]pyridazin-3-one CAS Name: 6-(4-bromophenyl)-2-[4-[4-(2-methoxyphenyl)-1-piperazinyl]-4-oxobutyl]-3-pyridazinone IUPAC Name: 6-(4-bromophenyl)-2-[4-[4-(2-methoxyphenyl)piperazin-1-yl]-4-oxobutyl]pyridazin-3-one Traditional Name: 6-(4-bromophenyl)-2-[4-keto-4-[4-(2-methoxyphenyl)piperazino]butyl]pyridazin-3-one Formula: C25H27BrN4O3 MolecularWeight: 511.41088

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(=O)CCCN3C(=O)C=CC(=N3)C4=CC=C(C=C4)Br

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=O)CCCN3C(=O)C=CC(=N3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C25H27BrN4O3/c1-33-23-6-3-2-5-22(23)28-15-17-29(18-16-28)24(31)7-4-14-30-25(32)13-12-21(27-30)19-8-10-20(26)11-9-19/h2-3,5-6,8-13H,4,7,14-18H2,1H3