N-ethyl-N-(phenylmethyl)-4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonyl-benzenesulfonamide

Systemtic Name: N-ethyl-N-(phenylmethyl)-4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonyl-benzenesulfonamide Openeye Name: N-benzyl-N-ethyl-4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonyl-benzenesulfonamide CAS Name: N-ethyl-N-(phenylmethyl)-4-[[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]sulfonyl]benzenesulfonamide IUPAC Name: N-benzyl-N-ethyl-4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylbenzenesulfonamide Traditional Name: N-benzyl-N-ethyl-4-[4-[3-(trifluoromethyl)phenyl]piperazino]sulfonyl-benzenesulfonamide Formula: C26H28F3N3O4S2 MolecularWeight: 567.64343

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

CCN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C26H28F3N3O4S2/c1-2-31(20-21-7-4-3-5-8-21)37(33,34)24-11-13-25(14-12-24)38(35,36)32-17-15-30(16-18-32)23-10-6-9-22(19-23)26(27,28)29/h3-14,19H,2,15-18,20H2,1H3