N-butan-2-yl-4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonyl-benzenesulfonamide

Systemtic Name: N-butan-2-yl-4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonyl-benzenesulfonamide Openeye Name: N-sec-butyl-4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonyl-benzenesulfonamide CAS Name: N-butan-2-yl-4-[[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]sulfonyl]benzenesulfonamide IUPAC Name: N-butan-2-yl-4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylbenzenesulfonamide Traditional Name: N-sec-butyl-4-[4-[3-(trifluoromethyl)phenyl]piperazino]sulfonyl-benzenesulfonamide Formula: C21H26F3N3O4S2 MolecularWeight: 505.57405

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26F3N3O4S2/c1-3-16(2)25-32(28,29)19-7-9-20(10-8-19)33(30,31)27-13-11-26(12-14-27)18-6-4-5-17(15-18)21(22,23)24/h4-10,15-16,25H,3,11-14H2,1-2H3