1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]-2-[3-(trifluoromethyl)phenyl]ethanone

Systemtic Name: 1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]-2-[3-(trifluoromethyl)phenyl]ethanone Openeye Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-[3-(trifluoromethyl)phenyl]ethanone CAS Name: 1-[4-(phenylmethyl)sulfonyl-1-piperazinyl]-2-[3-(trifluoromethyl)phenyl]ethanone IUPAC Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-[3-(trifluoromethyl)phenyl]ethanone Traditional Name: 1-(4-benzylsulfonylpiperazino)-2-[3-(trifluoromethyl)phenyl]ethanone Formula: C20H21F3N2O3S MolecularWeight: 426.45255

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CC2=CC(=CC=C2)C(F)(F)F)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=O)CC2=CC(=CC=C2)C(F)(F)F)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C20H21F3N2O3S/c21-20(22,23)18-8-4-7-17(13-18)14-19(26)24-9-11-25(12-10-24)29(27,28)15-16-5-2-1-3-6-16/h1-8,13H,9-12,14-15H2