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

Systemtic Name: 1-[2-(4-fluorophenyl)sulfanylethyl]-4-(4-methoxyphenyl)sulfonyl-piperazin-1-ium Openeye Name: 1-[2-(4-fluorophenyl)sulfanylethyl]-4-(4-methoxyphenyl)sulfonyl-piperazin-1-ium CAS Name: 1-[2-[(4-fluorophenyl)thio]ethyl]-4-(4-methoxyphenyl)sulfonylpiperazin-1-ium IUPAC Name: 1-[2-(4-fluorophenyl)sulfanylethyl]-4-(4-methoxyphenyl)sulfonylpiperazin-1-ium Traditional Name: 1-[2-[(4-fluorophenyl)thio]ethyl]-4-(4-methoxyphenyl)sulfonyl-piperazin-1-ium Formula: C19H24FN2O3S2+ MolecularWeight: 411.533863

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CCSC3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CCSC3=CC=C(C=C3)F

InChI

InChI=1S/C19H23FN2O3S2/c1-25-17-4-8-19(9-5-17)27(23,24)22-12-10-21(11-13-22)14-15-26-18-6-2-16(20)3-7-18/h2-9H,10-15H2,1H3/p+1