2-[4-[6-chloranyl-2-(1-methylcyclobutyl)sulfanyl-1H-benzimidazol-5-yl]piperazin-1-yl]ethanol dihydrochloride

Systemtic Name: 2-[4-[6-chloranyl-2-(1-methylcyclobutyl)sulfanyl-1H-benzimidazol-5-yl]piperazin-1-yl]ethanol dihydrochloride Openeye Name: 2-[4-[6-chloro-2-(1-methylcyclobutyl)sulfanyl-1H-benzimidazol-5-yl]piperazin-1-yl]ethanol dihydrochloride CAS Name: 2-[4-[6-chloro-2-[(1-methylcyclobutyl)thio]-1H-benzimidazol-5-yl]-1-piperazinyl]ethanol dihydrochloride IUPAC Name: 2-[4-[6-chloro-2-(1-methylcyclobutyl)sulfanyl-1H-benzimidazol-5-yl]piperazin-1-yl]ethanol dihydrochloride Traditional Name: 2-[4-[6-chloro-2-[(1-methylcyclobutyl)thio]-1H-benzimidazol-5-yl]piperazino]ethanol dihydrochloride Formula: C18H27Cl3N4OS MolecularWeight: 453.85718

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC1)SC2=NC3=CC(=C(C=C3N2)Cl)N4CCN(CC4)CCO.Cl.Cl

Isomeric SMILES

CC1(CCC1)SC2=NC3=CC(=C(C=C3N2)Cl)N4CCN(CC4)CCO.Cl.Cl

InChI

InChI=1S/C18H25ClN4OS.2ClH/c1-18(3-2-4-18)25-17-20-14-11-13(19)16(12-15(14)21-17)23-7-5-22(6-8-23)9-10-24;;/h11-12,24H,2-10H2,1H3,(H,20,21);2*1H