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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CCCN3C(=O)C=CC(=N3)C4=CC=C(C=C4)Br

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CCCN3C(=O)C=CC(=N3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C25H27BrN4O3/c1-33-22-10-8-21(9-11-22)28-15-17-29(18-16-28)24(31)3-2-14-30-25(32)13-12-23(27-30)19-4-6-20(26)7-5-19/h4-13H,2-3,14-18H2,1H3