[5-tert-butyl-2-methyl-4-(4-methylphenyl)sulfonylsulfanyl-phenyl] 4-fluoranylbenzenesulfonate

Systemtic Name: [5-tert-butyl-2-methyl-4-(4-methylphenyl)sulfonylsulfanyl-phenyl] 4-fluoranylbenzenesulfonate Openeye Name: [5-tert-butyl-2-methyl-4-(p-tolylsulfonylsulfanyl)phenyl] 4-fluorobenzenesulfonate CAS Name: 4-fluorobenzenesulfonic acid [5-tert-butyl-2-methyl-4-[(4-methylphenyl)sulfonylthio]phenyl] ester IUPAC Name: [5-tert-butyl-2-methyl-4-(4-methylphenyl)sulfonylsulfanylphenyl] 4-fluorobenzenesulfonate Traditional Name: 4-fluorobenzenesulfonic acid [5-tert-butyl-2-methyl-4-(tosylthio)phenyl] ester Formula: C24H25FO5S3 MolecularWeight: 508.645703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)SC2=CC(=C(C=C2C(C)(C)C)OS(=O)(=O)C3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)SC2=CC(=C(C=C2C(C)(C)C)OS(=O)(=O)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C24H25FO5S3/c1-16-6-10-20(11-7-16)33(28,29)31-23-14-17(2)22(15-21(23)24(3,4)5)30-32(26,27)19-12-8-18(25)9-13-19/h6-15H,1-5H3