6-(benzimidazol-1-yl)-2-[4-[4-(2-chlorophenyl)piperazin-1-yl]butyl]pyridazin-3-one

Systemtic Name: 6-(benzimidazol-1-yl)-2-[4-[4-(2-chlorophenyl)piperazin-1-yl]butyl]pyridazin-3-one Openeye Name: 6-(benzimidazol-1-yl)-2-[4-[4-(2-chlorophenyl)piperazin-1-yl]butyl]pyridazin-3-one CAS Name: 6-(1-benzimidazolyl)-2-[4-[4-(2-chlorophenyl)-1-piperazinyl]butyl]-3-pyridazinone IUPAC Name: 6-(benzimidazol-1-yl)-2-[4-[4-(2-chlorophenyl)piperazin-1-yl]butyl]pyridazin-3-one Traditional Name: 6-(benzimidazol-1-yl)-2-[4-[4-(2-chlorophenyl)piperazino]butyl]pyridazin-3-one Formula: C25H27ClN6O MolecularWeight: 462.97448

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCN2C(=O)C=CC(=N2)N3C=NC4=CC=CC=C43)C5=CC=CC=C5Cl

Isomeric SMILES

C1CN(CCN1CCCCN2C(=O)C=CC(=N2)N3C=NC4=CC=CC=C43)C5=CC=CC=C5Cl

InChI

InChI=1S/C25H27ClN6O/c26-20-7-1-3-9-22(20)30-17-15-29(16-18-30)13-5-6-14-32-25(33)12-11-24(28-32)31-19-27-21-8-2-4-10-23(21)31/h1-4,7-12,19H,5-6,13-18H2