4-(4-ethanoylpiperazin-1-yl)sulfonyl-N-[[4-fluoranyl-2-(trifluoromethyl)phenyl]methyl]benzamide

Systemtic Name: 4-(4-ethanoylpiperazin-1-yl)sulfonyl-N-[[4-fluoranyl-2-(trifluoromethyl)phenyl]methyl]benzamide Openeye Name: 4-(4-acetylpiperazin-1-yl)sulfonyl-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]benzamide CAS Name: 4-[(4-acetyl-1-piperazinyl)sulfonyl]-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]benzamide IUPAC Name: 4-(4-acetylpiperazin-1-yl)sulfonyl-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]benzamide Traditional Name: 4-(4-acetylpiperazino)sulfonyl-N-[4-fluoro-2-(trifluoromethyl)benzyl]benzamide Formula: C21H21F4N3O4S MolecularWeight: 487.467753

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCC3=C(C=C(C=C3)F)C(F)(F)F

Isomeric SMILES

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCC3=C(C=C(C=C3)F)C(F)(F)F

InChI

InChI=1S/C21H21F4N3O4S/c1-14(29)27-8-10-28(11-9-27)33(31,32)18-6-3-15(4-7-18)20(30)26-13-16-2-5-17(22)12-19(16)21(23,24)25/h2-7,12H,8-11,13H2,1H3,(H,26,30)