1-(2-fluorophenyl)sulfonyl-4-[2-(4-methylphenyl)sulfanylethyl]piperazin-4-ium

Systemtic Name: 1-(2-fluorophenyl)sulfonyl-4-[2-(4-methylphenyl)sulfanylethyl]piperazin-4-ium Openeye Name: 1-(2-fluorophenyl)sulfonyl-4-[2-(p-tolylsulfanyl)ethyl]piperazin-4-ium CAS Name: 1-(2-fluorophenyl)sulfonyl-4-[2-[(4-methylphenyl)thio]ethyl]piperazin-4-ium IUPAC Name: 1-(2-fluorophenyl)sulfonyl-4-[2-(4-methylphenyl)sulfanylethyl]piperazin-4-ium Traditional Name: 1-(2-fluorophenyl)sulfonyl-4-[2-(p-tolylthio)ethyl]piperazin-4-ium Formula: C19H24FN2O2S2+ MolecularWeight: 395.534463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

CC1=CC=C(C=C1)SCC[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C19H23FN2O2S2/c1-16-6-8-17(9-7-16)25-15-14-21-10-12-22(13-11-21)26(23,24)19-5-3-2-4-18(19)20/h2-9H,10-15H2,1H3/p+1