2-[4-(2-pentan-3-ylsulfanyl-3H-benzimidazol-5-yl)piperidin-1-yl]ethanol dihydrochloride

Systemtic Name: 2-[4-(2-pentan-3-ylsulfanyl-3H-benzimidazol-5-yl)piperidin-1-yl]ethanol dihydrochloride Openeye Name: 2-[4-[2-(1-ethylpropylsulfanyl)-3H-benzimidazol-5-yl]-1-piperidyl]ethanol dihydrochloride CAS Name: 2-[4-[2-(pentan-3-ylthio)-3H-benzimidazol-5-yl]-1-piperidinyl]ethanol dihydrochloride IUPAC Name: 2-[4-(2-pentan-3-ylsulfanyl-3H-benzimidazol-5-yl)piperidin-1-yl]ethanol dihydrochloride Traditional Name: 2-[4-[2-(1-ethylpropylthio)-3H-benzimidazol-5-yl]piperidino]ethanol dihydrochloride Formula: C19H31Cl2N3OS MolecularWeight: 420.43994

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)SC1=NC2=C(N1)C=C(C=C2)C3CCN(CC3)CCO.Cl.Cl

Isomeric SMILES

CCC(CC)SC1=NC2=C(N1)C=C(C=C2)C3CCN(CC3)CCO.Cl.Cl

InChI

InChI=1S/C19H29N3OS.2ClH/c1-3-16(4-2)24-19-20-17-6-5-15(13-18(17)21-19)14-7-9-22(10-8-14)11-12-23;;/h5-6,13-14,16,23H,3-4,7-12H2,1-2H3,(H,20,21);2*1H