1-[1-(2-fluorophenyl)butyl]-4-(4-methylphenyl)sulfonylsulfanyl-piperidine

Systemtic Name: 1-[1-(2-fluorophenyl)butyl]-4-(4-methylphenyl)sulfonylsulfanyl-piperidine Openeye Name: 1-[1-(2-fluorophenyl)butyl]-4-(p-tolylsulfonylsulfanyl)piperidine CAS Name: 1-[1-(2-fluorophenyl)butyl]-4-[(4-methylphenyl)sulfonylthio]piperidine IUPAC Name: 1-[1-(2-fluorophenyl)butyl]-4-(4-methylphenyl)sulfonylsulfanylpiperidine Traditional Name: 1-[1-(2-fluorophenyl)butyl]-4-(tosylthio)piperidine Formula: C22H28FNO2S2 MolecularWeight: 421.591623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1F)N2CCC(CC2)SS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCC(C1=CC=CC=C1F)N2CCC(CC2)SS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H28FNO2S2/c1-3-6-22(20-7-4-5-8-21(20)23)24-15-13-18(14-16-24)27-28(25,26)19-11-9-17(2)10-12-19/h4-5,7-12,18,22H,3,6,13-16H2,1-2H3