1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-(phenylmethylsulfanyl)propan-1-one

Systemtic Name: 1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-(phenylmethylsulfanyl)propan-1-one Openeye Name: 2-benzylsulfanyl-1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]propan-1-one CAS Name: 1-[4-(3-fluorophenyl)sulfonyl-1-piperazinyl]-2-(phenylmethylthio)-1-propanone IUPAC Name: 2-benzylsulfanyl-1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 2-(benzylthio)-1-[4-(3-fluorophenyl)sulfonylpiperazino]propan-1-one Formula: C20H23FN2O3S2 MolecularWeight: 422.536623

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23FN2O3S2/c1-16(27-15-17-6-3-2-4-7-17)20(24)22-10-12-23(13-11-22)28(25,26)19-9-5-8-18(21)14-19/h2-9,14,16H,10-13,15H2,1H3