4-tert-butyl-N-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylethyl]benzamide

Systemtic Name: 4-tert-butyl-N-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylethyl]benzamide Openeye Name: 4-tert-butyl-N-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylethyl]benzamide CAS Name: 4-tert-butyl-N-[2-[[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]sulfonyl]ethyl]benzamide IUPAC Name: 4-tert-butyl-N-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylethyl]benzamide Traditional Name: 4-tert-butyl-N-[2-[4-[3-(trifluoromethyl)phenyl]piperazino]sulfonylethyl]benzamide Formula: C24H30F3N3O3S MolecularWeight: 497.57351

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NCCS(=O)(=O)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NCCS(=O)(=O)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C24H30F3N3O3S/c1-23(2,3)19-9-7-18(8-10-19)22(31)28-11-16-34(32,33)30-14-12-29(13-15-30)21-6-4-5-20(17-21)24(25,26)27/h4-10,17H,11-16H2,1-3H3,(H,28,31)