4-(4-methylsulfonylpiperazin-1-yl)-1-[4-[4-(trifluoromethyloxy)phenoxy]phenyl]sulfonyl-butan-2-ol

Systemtic Name: 4-(4-methylsulfonylpiperazin-1-yl)-1-[4-[4-(trifluoromethyloxy)phenoxy]phenyl]sulfonyl-butan-2-ol Openeye Name: 4-(4-methylsulfonylpiperazin-1-yl)-1-[4-[4-(trifluoromethoxy)phenoxy]phenyl]sulfonyl-butan-2-ol CAS Name: 4-(4-methylsulfonyl-1-piperazinyl)-1-[4-[4-(trifluoromethoxy)phenoxy]phenyl]sulfonyl-2-butanol IUPAC Name: 4-(4-methylsulfonylpiperazin-1-yl)-1-[4-[4-(trifluoromethoxy)phenoxy]phenyl]sulfonylbutan-2-ol Traditional Name: 4-(4-mesylpiperazino)-1-[4-[4-(trifluoromethoxy)phenoxy]phenyl]sulfonyl-butan-2-ol Formula: C22H27F3N2O7S2 MolecularWeight: 552.58419

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)CCC(CS(=O)(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)OC(F)(F)F)O

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)CCC(CS(=O)(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)OC(F)(F)F)O

InChI

InChI=1S/C22H27F3N2O7S2/c1-35(29,30)27-14-12-26(13-15-27)11-10-17(28)16-36(31,32)21-8-6-19(7-9-21)33-18-2-4-20(5-3-18)34-22(23,24)25/h2-9,17,28H,10-16H2,1H3