4-[[6-[4-(2-hydroxyethyl)piperazin-1-yl]-1H-benzimidazol-2-yl]sulfanyl]cyclohexan-1-ol dihydrochloride

Systemtic Name: 4-[[6-[4-(2-hydroxyethyl)piperazin-1-yl]-1H-benzimidazol-2-yl]sulfanyl]cyclohexan-1-ol dihydrochloride Openeye Name: 4-[[6-[4-(2-hydroxyethyl)piperazin-1-yl]-1H-benzimidazol-2-yl]sulfanyl]cyclohexanol dihydrochloride CAS Name: 4-[[6-[4-(2-hydroxyethyl)-1-piperazinyl]-1H-benzimidazol-2-yl]thio]-1-cyclohexanol dihydrochloride IUPAC Name: 4-[[6-[4-(2-hydroxyethyl)piperazin-1-yl]-1H-benzimidazol-2-yl]sulfanyl]cyclohexan-1-ol dihydrochloride Traditional Name: 4-[[6-[4-(2-hydroxyethyl)piperazino]-1H-benzimidazol-2-yl]thio]cyclohexanol dihydrochloride Formula: C19H30Cl2N4O2S MolecularWeight: 449.4381

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1O)SC2=NC3=C(N2)C=C(C=C3)N4CCN(CC4)CCO.Cl.Cl

Isomeric SMILES

C1CC(CCC1O)SC2=NC3=C(N2)C=C(C=C3)N4CCN(CC4)CCO.Cl.Cl

InChI

InChI=1S/C19H28N4O2S.2ClH/c24-12-11-22-7-9-23(10-8-22)14-1-6-17-18(13-14)21-19(20-17)26-16-4-2-15(25)3-5-16;;/h1,6,13,15-16,24-25H,2-5,7-12H2,(H,20,21);2*1H