1-[3-[4-[4-(trifluoromethylsulfanyl)phenyl]carbonylpiperazin-1-yl]sulfonylphenyl]ethanone

Systemtic Name: 1-[3-[4-[4-(trifluoromethylsulfanyl)phenyl]carbonylpiperazin-1-yl]sulfonylphenyl]ethanone Openeye Name: 1-[3-[4-[4-(trifluoromethylsulfanyl)benzoyl]piperazin-1-yl]sulfonylphenyl]ethanone CAS Name: 1-[3-[[4-[oxo-[4-(trifluoromethylthio)phenyl]methyl]-1-piperazinyl]sulfonyl]phenyl]ethanone IUPAC Name: 1-[3-[4-[4-(trifluoromethylsulfanyl)benzoyl]piperazin-1-yl]sulfonylphenyl]ethanone Traditional Name: 1-[3-[4-[4-(trifluoromethylthio)benzoyl]piperazino]sulfonylphenyl]ethanone Formula: C20H19F3N2O4S2 MolecularWeight: 472.50107

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)SC(F)(F)F

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)SC(F)(F)F

InChI

InChI=1S/C20H19F3N2O4S2/c1-14(26)16-3-2-4-18(13-16)31(28,29)25-11-9-24(10-12-25)19(27)15-5-7-17(8-6-15)30-20(21,22)23/h2-8,13H,9-12H2,1H3