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

Systemtic Name: 6-(4-bromophenyl)-2-[4-oxidanylidene-4-[4-(phenylmethyl)piperazin-1-yl]butyl]pyridazin-3-one Openeye Name: 2-[4-(4-benzylpiperazin-1-yl)-4-oxo-butyl]-6-(4-bromophenyl)pyridazin-3-one CAS Name: 6-(4-bromophenyl)-2-[4-oxo-4-[4-(phenylmethyl)-1-piperazinyl]butyl]-3-pyridazinone IUPAC Name: 2-[4-(4-benzylpiperazin-1-yl)-4-oxobutyl]-6-(4-bromophenyl)pyridazin-3-one Traditional Name: 2-[4-(4-benzylpiperazino)-4-keto-butyl]-6-(4-bromophenyl)pyridazin-3-one Formula: C25H27BrN4O2 MolecularWeight: 495.41148

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)CCCN3C(=O)C=CC(=N3)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)CCCN3C(=O)C=CC(=N3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C25H27BrN4O2/c26-22-10-8-21(9-11-22)23-12-13-25(32)30(27-23)14-4-7-24(31)29-17-15-28(16-18-29)19-20-5-2-1-3-6-20/h1-3,5-6,8-13H,4,7,14-19H2