1-(methylcarbamothioyl)-N-oxidanyl-4-[4-[4-(trifluoromethyloxy)phenoxy]phenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: 1-(methylcarbamothioyl)-N-oxidanyl-4-[4-[4-(trifluoromethyloxy)phenoxy]phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: 4-(hydroxycarbamoyl)-N-methyl-4-[4-[4-(trifluoromethoxy)phenoxy]phenyl]sulfonyl-piperidine-1-carbothioamide CAS Name: N-hydroxy-1-[methylamino(sulfanylidene)methyl]-4-[4-[4-(trifluoromethoxy)phenoxy]phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-hydroxy-1-(methylcarbamothioyl)-4-[4-[4-(trifluoromethoxy)phenoxy]phenyl]sulfonylpiperidine-4-carboxamide Traditional Name: 4-(hydroxycarbamoyl)-N-methyl-4-[4-[4-(trifluoromethoxy)phenoxy]phenyl]sulfonyl-piperidine-1-carbothioamide Formula: C21H22F3N3O6S2 MolecularWeight: 533.54109

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)N1CCC(CC1)(C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

CNC(=S)N1CCC(CC1)(C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C21H22F3N3O6S2/c1-25-19(34)27-12-10-20(11-13-27,18(28)26-29)35(30,31)17-8-6-15(7-9-17)32-14-2-4-16(5-3-14)33-21(22,23)24/h2-9,29H,10-13H2,1H3,(H,25,34)(H,26,28)