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

Systemtic Name: 6-(benzimidazol-1-yl)-2-[6-[4-(2-chlorophenyl)piperazin-1-yl]hexyl]pyridazin-3-one Openeye Name: 6-(benzimidazol-1-yl)-2-[6-[4-(2-chlorophenyl)piperazin-1-yl]hexyl]pyridazin-3-one CAS Name: 6-(1-benzimidazolyl)-2-[6-[4-(2-chlorophenyl)-1-piperazinyl]hexyl]-3-pyridazinone IUPAC Name: 6-(benzimidazol-1-yl)-2-[6-[4-(2-chlorophenyl)piperazin-1-yl]hexyl]pyridazin-3-one Traditional Name: 6-(benzimidazol-1-yl)-2-[6-[4-(2-chlorophenyl)piperazino]hexyl]pyridazin-3-one Formula: C27H31ClN6O MolecularWeight: 491.02764

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCCCN2C(=O)C=CC(=N2)N3C=NC4=CC=CC=C43)C5=CC=CC=C5Cl

Isomeric SMILES

C1CN(CCN1CCCCCCN2C(=O)C=CC(=N2)N3C=NC4=CC=CC=C43)C5=CC=CC=C5Cl

InChI

InChI=1S/C27H31ClN6O/c28-22-9-3-5-11-24(22)32-19-17-31(18-20-32)15-7-1-2-8-16-34-27(35)14-13-26(30-34)33-21-29-23-10-4-6-12-25(23)33/h3-6,9-14,21H,1-2,7-8,15-20H2