1-[4-(4-fluorophenyl)piperazin-1-yl]-2-(phenylmethylsulfanyl)propan-1-one hydrochloride

Systemtic Name: 1-[4-(4-fluorophenyl)piperazin-1-yl]-2-(phenylmethylsulfanyl)propan-1-one hydrochloride Openeye Name: 2-benzylsulfanyl-1-[4-(4-fluorophenyl)piperazin-1-yl]propan-1-one hydrochloride CAS Name: 1-[4-(4-fluorophenyl)-1-piperazinyl]-2-(phenylmethylthio)-1-propanone hydrochloride IUPAC Name: 2-benzylsulfanyl-1-[4-(4-fluorophenyl)piperazin-1-yl]propan-1-one hydrochloride Traditional Name: 2-(benzylthio)-1-[4-(4-fluorophenyl)piperazino]propan-1-one hydrochloride Formula: C20H24ClFN2OS MolecularWeight: 394.933763

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC=C(C=C2)F)SCC3=CC=CC=C3.Cl

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C2=CC=C(C=C2)F)SCC3=CC=CC=C3.Cl

InChI

InChI=1S/C20H23FN2OS.ClH/c1-16(25-15-17-5-3-2-4-6-17)20(24)23-13-11-22(12-14-23)19-9-7-18(21)8-10-19;/h2-10,16H,11-15H2,1H3;1H