4-bromanyl-N-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]-2-(trifluoromethyloxy)benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]-2-(trifluoromethyloxy)benzenesulfonamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)ethyl]-4-bromo-2-(trifluoromethoxy)benzenesulfonamide CAS Name: 4-bromo-N-[2-[4-(phenylmethyl)-1-piperazinyl]ethyl]-2-(trifluoromethoxy)benzenesulfonamide IUPAC Name: N-[2-(4-benzylpiperazin-1-yl)ethyl]-4-bromo-2-(trifluoromethoxy)benzenesulfonamide Traditional Name: N-[2-(4-benzylpiperazino)ethyl]-4-bromo-2-(trifluoromethoxy)benzenesulfonamide Formula: C20H23BrF3N3O3S MolecularWeight: 522.37913

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNS(=O)(=O)C2=C(C=C(C=C2)Br)OC(F)(F)F)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CCNS(=O)(=O)C2=C(C=C(C=C2)Br)OC(F)(F)F)CC3=CC=CC=C3

InChI

InChI=1S/C20H23BrF3N3O3S/c21-17-6-7-19(18(14-17)30-20(22,23)24)31(28,29)25-8-9-26-10-12-27(13-11-26)15-16-4-2-1-3-5-16/h1-7,14,25H,8-13,15H2