2-[4-[6-chloranyl-2-(2-methyl-1-piperidin-1-yl-propan-2-yl)sulfanyl-1H-benzimidazol-5-yl]piperazin-1-yl]ethanol trihydrochloride

Systemtic Name: 2-[4-[6-chloranyl-2-(2-methyl-1-piperidin-1-yl-propan-2-yl)sulfanyl-1H-benzimidazol-5-yl]piperazin-1-yl]ethanol trihydrochloride Openeye Name: 2-[4-[6-chloro-2-[1,1-dimethyl-2-(1-piperidyl)ethyl]sulfanyl-1H-benzimidazol-5-yl]piperazin-1-yl]ethanol trihydrochloride CAS Name: 2-[4-[6-chloro-2-[[2-methyl-1-(1-piperidinyl)propan-2-yl]thio]-1H-benzimidazol-5-yl]-1-piperazinyl]ethanol trihydrochloride IUPAC Name: 2-[4-[6-chloro-2-(2-methyl-1-piperidin-1-ylpropan-2-yl)sulfanyl-1H-benzimidazol-5-yl]piperazin-1-yl]ethanol trihydrochloride Traditional Name: 2-[4-[6-chloro-2-[(1,1-dimethyl-2-piperidino-ethyl)thio]-1H-benzimidazol-5-yl]piperazino]ethanol trihydrochloride Formula: C22H37Cl4N5OS MolecularWeight: 561.43908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN1CCCCC1)SC2=NC3=CC(=C(C=C3N2)Cl)N4CCN(CC4)CCO.Cl.Cl.Cl

Isomeric SMILES

CC(C)(CN1CCCCC1)SC2=NC3=CC(=C(C=C3N2)Cl)N4CCN(CC4)CCO.Cl.Cl.Cl

InChI

InChI=1S/C22H34ClN5OS.3ClH/c1-22(2,16-27-6-4-3-5-7-27)30-21-24-18-14-17(23)20(15-19(18)25-21)28-10-8-26(9-11-28)12-13-29;;;/h14-15,29H,3-13,16H2,1-2H3,(H,24,25);3*1H