5-chloranyl-2-pentan-3-ylsulfanyl-6-piperidin-4-yl-1H-benzimidazole dihydrochloride

Systemtic Name: 5-chloranyl-2-pentan-3-ylsulfanyl-6-piperidin-4-yl-1H-benzimidazole dihydrochloride Openeye Name: 5-chloro-2-(1-ethylpropylsulfanyl)-6-(4-piperidyl)-1H-benzimidazole dihydrochloride CAS Name: 5-chloro-2-(pentan-3-ylthio)-6-(4-piperidinyl)-1H-benzimidazole dihydrochloride IUPAC Name: 5-chloro-2-pentan-3-ylsulfanyl-6-piperidin-4-yl-1H-benzimidazole dihydrochloride Traditional Name: 5-chloro-2-(1-ethylpropylthio)-6-(4-piperidyl)-1H-benzimidazole dihydrochloride Formula: C17H26Cl3N3S MolecularWeight: 410.83244

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)SC1=NC2=C(N1)C=C(C(=C2)Cl)C3CCNCC3.Cl.Cl

Isomeric SMILES

CCC(CC)SC1=NC2=C(N1)C=C(C(=C2)Cl)C3CCNCC3.Cl.Cl

InChI

InChI=1S/C17H24ClN3S.2ClH/c1-3-12(4-2)22-17-20-15-9-13(11-5-7-19-8-6-11)14(18)10-16(15)21-17;;/h9-12,19H,3-8H2,1-2H3,(H,20,21);2*1H