1-(4-bromophenyl)sulfanyl-3-[4-(phenylmethyl)piperidin-1-yl]propan-2-ol hydrochloride

Systemtic Name: 1-(4-bromophenyl)sulfanyl-3-[4-(phenylmethyl)piperidin-1-yl]propan-2-ol hydrochloride Openeye Name: 1-(4-benzyl-1-piperidyl)-3-(4-bromophenyl)sulfanyl-propan-2-ol hydrochloride CAS Name: 1-[(4-bromophenyl)thio]-3-[4-(phenylmethyl)-1-piperidinyl]-2-propanol hydrochloride IUPAC Name: 1-(4-benzylpiperidin-1-yl)-3-(4-bromophenyl)sulfanylpropan-2-ol hydrochloride Traditional Name: 1-(4-benzylpiperidino)-3-[(4-bromophenyl)thio]propan-2-ol hydrochloride Formula: C21H27BrClNOS MolecularWeight: 456.86718

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)CC(CSC3=CC=C(C=C3)Br)O.Cl

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)CC(CSC3=CC=C(C=C3)Br)O.Cl

InChI

InChI=1S/C21H26BrNOS.ClH/c22-19-6-8-21(9-7-19)25-16-20(24)15-23-12-10-18(11-13-23)14-17-4-2-1-3-5-17;/h1-9,18,20,24H,10-16H2;1H