1-cyclopropyl-2-[4-(4-methylphenyl)sulfonylsulfanylpiperidin-1-yl]-2-[2-(trifluoromethyl)phenyl]ethanone

Systemtic Name: 1-cyclopropyl-2-[4-(4-methylphenyl)sulfonylsulfanylpiperidin-1-yl]-2-[2-(trifluoromethyl)phenyl]ethanone Openeye Name: 1-cyclopropyl-2-[4-(p-tolylsulfonylsulfanyl)-1-piperidyl]-2-[2-(trifluoromethyl)phenyl]ethanone CAS Name: 1-cyclopropyl-2-[4-[(4-methylphenyl)sulfonylthio]-1-piperidinyl]-2-[2-(trifluoromethyl)phenyl]ethanone IUPAC Name: 1-cyclopropyl-2-[4-(4-methylphenyl)sulfonylsulfanylpiperidin-1-yl]-2-[2-(trifluoromethyl)phenyl]ethanone Traditional Name: 1-cyclopropyl-2-[4-(tosylthio)piperidino]-2-[2-(trifluoromethyl)phenyl]ethanone Formula: C24H26F3NO3S2 MolecularWeight: 497.59335

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)SC2CCN(CC2)C(C3=CC=CC=C3C(F)(F)F)C(=O)C4CC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)SC2CCN(CC2)C(C3=CC=CC=C3C(F)(F)F)C(=O)C4CC4

InChI

InChI=1S/C24H26F3NO3S2/c1-16-6-10-19(11-7-16)33(30,31)32-18-12-14-28(15-13-18)22(23(29)17-8-9-17)20-4-2-3-5-21(20)24(25,26)27/h2-7,10-11,17-18,22H,8-9,12-15H2,1H3