1-[4-(phenylsulfonyl)piperazin-1-yl]-2-[3-(trifluoromethyl)phenyl]sulfanyl-ethanone

Systemtic Name: 1-[4-(phenylsulfonyl)piperazin-1-yl]-2-[3-(trifluoromethyl)phenyl]sulfanyl-ethanone Openeye Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-[3-(trifluoromethyl)phenyl]sulfanyl-ethanone CAS Name: 1-[4-(benzenesulfonyl)-1-piperazinyl]-2-[[3-(trifluoromethyl)phenyl]thio]ethanone IUPAC Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-[3-(trifluoromethyl)phenyl]sulfanylethanone Traditional Name: 1-(4-besylpiperazino)-2-[[3-(trifluoromethyl)phenyl]thio]ethanone Formula: C19H19F3N2O3S2 MolecularWeight: 444.49097

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CSC2=CC=CC(=C2)C(F)(F)F)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=O)CSC2=CC=CC(=C2)C(F)(F)F)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H19F3N2O3S2/c20-19(21,22)15-5-4-6-16(13-15)28-14-18(25)23-9-11-24(12-10-23)29(26,27)17-7-2-1-3-8-17/h1-8,13H,9-12,14H2