4-[2-[(6-piperazin-1-yl-1H-benzimidazol-2-yl)sulfanyl]propyl]morpholine trihydrochloride

Systemtic Name: 4-[2-[(6-piperazin-1-yl-1H-benzimidazol-2-yl)sulfanyl]propyl]morpholine trihydrochloride Openeye Name: 4-[2-[(6-piperazin-1-yl-1H-benzimidazol-2-yl)sulfanyl]propyl]morpholine trihydrochloride CAS Name: 4-[2-[[6-(1-piperazinyl)-1H-benzimidazol-2-yl]thio]propyl]morpholine trihydrochloride IUPAC Name: 4-[2-[(6-piperazin-1-yl-1H-benzimidazol-2-yl)sulfanyl]propyl]morpholine trihydrochloride Traditional Name: 4-[2-[(6-piperazino-1H-benzimidazol-2-yl)thio]propyl]morpholine trihydrochloride Formula: C18H30Cl3N5OS MolecularWeight: 470.8877

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CCOCC1)SC2=NC3=C(N2)C=C(C=C3)N4CCNCC4.Cl.Cl.Cl

Isomeric SMILES

CC(CN1CCOCC1)SC2=NC3=C(N2)C=C(C=C3)N4CCNCC4.Cl.Cl.Cl

InChI

InChI=1S/C18H27N5OS.3ClH/c1-14(13-22-8-10-24-11-9-22)25-18-20-16-3-2-15(12-17(16)21-18)23-6-4-19-5-7-23;;;/h2-3,12,14,19H,4-11,13H2,1H3,(H,20,21);3*1H