Benzenesulfonyl compounds

Organosulfur compounds that consist of a benzene ring substituted with a sulfonyl group that is subsequently bonded to an organic functional group.

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4-Methylsulphonylbenzylamine hydrochloride, 95%

CAS: 4393-16-2 Molecular Formula: C8H11NO2S Molecular Weight (g/mol): 185.241 MDL Number: MFCD00216491 InChI Key: VMNXLLDFGVEBLE-UHFFFAOYSA-N Synonym: 4-methylsulfonyl benzylamine,4-methanesulfonylphenyl methanamine,4-methylsulfonyl phenyl methanamine,4-methylsulfonylbenzylamine,benzenemethanamine, 4-methylsulfonyl,unii-61o466wzw2,4-methanesulfonyl benzylamine,4-methylsulfonyl benzenemethanamine,4-methanesulfonylphenyl methylamine,4-methanesulfonyl-benzylamine PubChem CID: 57421 IUPAC Name: (4-methylsulfonylphenyl)methanamine SMILES: CS(=O)(=O)C1=CC=C(C=C1)CN

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PubChem CID	57421
CAS	4393-16-2
Molecular Weight (g/mol)	185.241
MDL Number	MFCD00216491
SMILES	CS(=O)(=O)C1=CC=C(C=C1)CN
Synonym	4-methylsulfonyl benzylamine,4-methanesulfonylphenyl methanamine,4-methylsulfonyl phenyl methanamine,4-methylsulfonylbenzylamine,benzenemethanamine, 4-methylsulfonyl,unii-61o466wzw2,4-methanesulfonyl benzylamine,4-methylsulfonyl benzenemethanamine,4-methanesulfonylphenyl methylamine,4-methanesulfonyl-benzylamine
IUPAC Name	(4-methylsulfonylphenyl)methanamine
InChI Key	VMNXLLDFGVEBLE-UHFFFAOYSA-N
Molecular Formula	C8H11NO2S

4,4'-Diaminodiphenyl sulfone, 98%

CAS: 80-08-0 Molecular Formula: C12H12N2O2S Molecular Weight (g/mol): 248.3 MDL Number: MFCD00007887 InChI Key: MQJKPEGWNLWLTK-UHFFFAOYSA-N Synonym: dapsone,diaphenylsulfone,4,4'-diaminodiphenyl sulfone,dapson,4,4'-sulfonyldianiline,diaphenylsulfon,sulfona,4-aminophenyl sulfone,avlosulfone,diphenasone PubChem CID: 2955 ChEBI: CHEBI:4325 IUPAC Name: 4-(4-aminophenyl)sulfonylaniline SMILES: C1=CC(=CC=C1N)S(=O)(=O)C2=CC=C(C=C2)N

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PubChem CID	2955
CAS	80-08-0
Molecular Weight (g/mol)	248.3
ChEBI	CHEBI:4325
MDL Number	MFCD00007887
SMILES	C1=CC(=CC=C1N)S(=O)(=O)C2=CC=C(C=C2)N
Synonym	dapsone,diaphenylsulfone,4,4'-diaminodiphenyl sulfone,dapson,4,4'-sulfonyldianiline,diaphenylsulfon,sulfona,4-aminophenyl sulfone,avlosulfone,diphenasone
IUPAC Name	4-(4-aminophenyl)sulfonylaniline
InChI Key	MQJKPEGWNLWLTK-UHFFFAOYSA-N
Molecular Formula	C12H12N2O2S

Methyl phenyl sulfone, 99%

CAS: 3112-85-4 Molecular Formula: C₇H₈O₂S Molecular Weight (g/mol): 156.2 MDL Number: MFCD00014741 InChI Key: JCDWETOKTFWTHA-UHFFFAOYSA-N Synonym: methyl phenyl sulfone,methylsulfonyl benzene,phenyl methyl sulfone,benzene, methylsulfonyl,sulfone, methyl phenyl,phenylsulfonyl methane,methylphenylsulfone,methylsulphonyl benzene,methanesulfonylbenzene,methyl phenyl sulphone PubChem CID: 18369 IUPAC Name: methylsulfonylbenzene SMILES: CS(=O)(=O)C1=CC=CC=C1

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PubChem CID	18369
CAS	3112-85-4
Molecular Weight (g/mol)	156.2
MDL Number	MFCD00014741
SMILES	CS(=O)(=O)C1=CC=CC=C1
Synonym	methyl phenyl sulfone,methylsulfonyl benzene,phenyl methyl sulfone,benzene, methylsulfonyl,sulfone, methyl phenyl,phenylsulfonyl methane,methylphenylsulfone,methylsulphonyl benzene,methanesulfonylbenzene,methyl phenyl sulphone
IUPAC Name	methylsulfonylbenzene
InChI Key	JCDWETOKTFWTHA-UHFFFAOYSA-N
Molecular Formula	C₇H₈O₂S

Methyl phenylsulfonylacetate, 98%

CAS: 34097-60-4 Molecular Formula: C9H10O4S Molecular Weight (g/mol): 214.235 MDL Number: MFCD00007555 InChI Key: NLEAIFBNKPYTGN-UHFFFAOYSA-N PubChem CID: 555619 IUPAC Name: methyl 2-(benzenesulfonyl)acetate SMILES: COC(=O)CS(=O)(=O)C1=CC=CC=C1

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PubChem CID	555619
CAS	34097-60-4
Molecular Weight (g/mol)	214.235
MDL Number	MFCD00007555
SMILES	COC(=O)CS(=O)(=O)C1=CC=CC=C1
IUPAC Name	methyl 2-(benzenesulfonyl)acetate
InChI Key	NLEAIFBNKPYTGN-UHFFFAOYSA-N
Molecular Formula	C9H10O4S

4-(Trifluoromethylsulfonyl)benzonitrile, 97+%

CAS: 312-21-0 Molecular Formula: C8H4F3NO2S Molecular Weight (g/mol): 235.18 MDL Number: MFCD01631631 InChI Key: UHCGSMMNICMDIX-UHFFFAOYSA-N Synonym: 4-trifluoromethylsulfonyl benzonitrile,4-trifluoromethyl sulfonyl benzonitrile,4-trifluoromethanesulfonyl benzonitrile,4-trifluoromethanesulfonylbenzonitrile,4-trifluoromethyl sulfonyl benzenecarbonitrile,acmc-1clj3,4-trifluoromethanesulphonylbenzonitrile,4-trifluoromethylsulfonyl benzonitril PubChem CID: 2777824 IUPAC Name: 4-(trifluoromethylsulfonyl)benzonitrile SMILES: C1=CC(=CC=C1C#N)S(=O)(=O)C(F)(F)F

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PubChem CID	2777824
CAS	312-21-0
Molecular Weight (g/mol)	235.18
MDL Number	MFCD01631631
SMILES	C1=CC(=CC=C1C#N)S(=O)(=O)C(F)(F)F
Synonym	4-trifluoromethylsulfonyl benzonitrile,4-trifluoromethyl sulfonyl benzonitrile,4-trifluoromethanesulfonyl benzonitrile,4-trifluoromethanesulfonylbenzonitrile,4-trifluoromethyl sulfonyl benzenecarbonitrile,acmc-1clj3,4-trifluoromethanesulphonylbenzonitrile,4-trifluoromethylsulfonyl benzonitril
IUPAC Name	4-(trifluoromethylsulfonyl)benzonitrile
InChI Key	UHCGSMMNICMDIX-UHFFFAOYSA-N
Molecular Formula	C8H4F3NO2S

1,2-Bis(phenylsulfonyl)ethane, 98+%

CAS: 599-94-0 Molecular Formula: C14H14O4S2 Molecular Weight (g/mol): 310.38 MDL Number: MFCD00041256 InChI Key: ULELOBVZIKJPAC-UHFFFAOYSA-N Synonym: 1,2-bis phenylsulfonyl ethane,1,2-bis phenylsulphonyl ethane,1,1'-ethane-1,2-diylbis sulphonyl bisbenzene,2-benzenesulfonyl ethylsulfonylbenzene,ethylenebisphenyl sulfone,2-phenylsulfonyl ethyl sulfonyl benzene,2-benzenesulfonyl ethanesulfonyl benzene,1,1'-ethane-1,2-diyldisulfonyl dibenzene,ethylene diphenylsulfone,acmc-1apw3 PubChem CID: 69036 IUPAC Name: 2-(benzenesulfonyl)ethylsulfonylbenzene SMILES: O=S(=O)(CCS(=O)(=O)C1=CC=CC=C1)C1=CC=CC=C1

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PubChem CID	69036
CAS	599-94-0
Molecular Weight (g/mol)	310.38
MDL Number	MFCD00041256
SMILES	O=S(=O)(CCS(=O)(=O)C1=CC=CC=C1)C1=CC=CC=C1
Synonym	1,2-bis phenylsulfonyl ethane,1,2-bis phenylsulphonyl ethane,1,1'-ethane-1,2-diylbis sulphonyl bisbenzene,2-benzenesulfonyl ethylsulfonylbenzene,ethylenebisphenyl sulfone,2-phenylsulfonyl ethyl sulfonyl benzene,2-benzenesulfonyl ethanesulfonyl benzene,1,1'-ethane-1,2-diyldisulfonyl dibenzene,ethylene diphenylsulfone,acmc-1apw3
IUPAC Name	2-(benzenesulfonyl)ethylsulfonylbenzene
InChI Key	ULELOBVZIKJPAC-UHFFFAOYSA-N
Molecular Formula	C14H14O4S2

Difluoromethyl phenyl sulfone, 95%

CAS: 1535-65-5 Molecular Formula: C7H6F2O2S Molecular Weight (g/mol): 192.18 MDL Number: MFCD01050170 InChI Key: LRHDNAVPELLXDL-UHFFFAOYSA-N Synonym: difluoromethyl sulfonyl benzene,difluoromethyl phenyl sulfone,difluoromethanesulfonylbenzene,phenyl difluoromethyl sulfone,benzene, difluoromethyl sulfonyl,difluoromethyl sulfonylbenzene,difluoro-methanesulfonyl-benzene,difluoromethyl sulfonyl-benzene PubChem CID: 11816356 IUPAC Name: difluoromethylsulfonylbenzene SMILES: C1=CC=C(C=C1)S(=O)(=O)C(F)F

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PubChem CID	11816356
CAS	1535-65-5
Molecular Weight (g/mol)	192.18
MDL Number	MFCD01050170
SMILES	C1=CC=C(C=C1)S(=O)(=O)C(F)F
Synonym	difluoromethyl sulfonyl benzene,difluoromethyl phenyl sulfone,difluoromethanesulfonylbenzene,phenyl difluoromethyl sulfone,benzene, difluoromethyl sulfonyl,difluoromethyl sulfonylbenzene,difluoro-methanesulfonyl-benzene,difluoromethyl sulfonyl-benzene
IUPAC Name	difluoromethylsulfonylbenzene
InChI Key	LRHDNAVPELLXDL-UHFFFAOYSA-N
Molecular Formula	C7H6F2O2S

Dapsone, USP, 98-102%, Spectrum™ Chemical

CAS: 80-08-0 Molecular Formula: C12H12N2O2S Molecular Weight (g/mol): 248.30 InChI Key: MQJKPEGWNLWLTK-UHFFFAOYSA-N IUPAC Name: 4-(4-aminobenzenesulfonyl)aniline SMILES: NC1=CC=C(C=C1)S(=O)(=O)C1=CC=C(N)C=C1

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CAS	80-08-0
Molecular Weight (g/mol)	248.30
SMILES	NC1=CC=C(C=C1)S(=O)(=O)C1=CC=C(N)C=C1
IUPAC Name	4-(4-aminobenzenesulfonyl)aniline
InChI Key	MQJKPEGWNLWLTK-UHFFFAOYSA-N
Molecular Formula	C12H12N2O2S

4-Fluorophenylsulfonylacetonitrile, 97%

CAS: 32083-66-2 Molecular Formula: C8H6FNO2S Molecular Weight (g/mol): 199.199 MDL Number: MFCD00179339 InChI Key: WBXJZTLPEMITJL-UHFFFAOYSA-N Synonym: 4-fluorobenzenesulfonyl acetonitrile,2-4-fluorophenyl sulfonyl acetonitrile,4-fluorobenzenesulphonyl acetonitrile,4-fluorophenyl sulfonyl acetonitrile,2-4-fluorobenzenesulfonyl acetonitrile,4-fluorophenylsulfonylacetonitrile,4-fluorobenzenesulfonylacetonitrile,2-4-fluorophenyl sulfonylacetonitrile,4-fluorophenylsulfonyl acetonitrile PubChem CID: 565732 IUPAC Name: 2-(4-fluorophenyl)sulfonylacetonitrile SMILES: C1=CC(=CC=C1F)S(=O)(=O)CC#N

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PubChem CID	565732
CAS	32083-66-2
Molecular Weight (g/mol)	199.199
MDL Number	MFCD00179339
SMILES	C1=CC(=CC=C1F)S(=O)(=O)CC#N
Synonym	4-fluorobenzenesulfonyl acetonitrile,2-4-fluorophenyl sulfonyl acetonitrile,4-fluorobenzenesulphonyl acetonitrile,4-fluorophenyl sulfonyl acetonitrile,2-4-fluorobenzenesulfonyl acetonitrile,4-fluorophenylsulfonylacetonitrile,4-fluorobenzenesulfonylacetonitrile,2-4-fluorophenyl sulfonylacetonitrile,4-fluorophenylsulfonyl acetonitrile
IUPAC Name	2-(4-fluorophenyl)sulfonylacetonitrile
InChI Key	WBXJZTLPEMITJL-UHFFFAOYSA-N
Molecular Formula	C8H6FNO2S

Phenyl trans-beta-styryl sulfone, 96%

CAS: 16212-06-9 Molecular Formula: C14H12O2S Molecular Weight (g/mol): 244.308 MDL Number: MFCD00159177 InChI Key: DNMCCXFLTURVLK-VAWYXSNFSA-N Synonym: phenyl trans-styryl sulfone,phenyl styryl sulfone,sulfone, phenyl styryl,phenyl trans-styryl sulphone,phenyl 2-phenylvinyl sulfone,benzene, 2-phenylethenyl sulfonyl,e-2-benzenesulfonyl ethenyl benzene,1e-2-phenylvinyl sulfonyl benzene,styrylsulfonylbenzene,e-2-phenylethenyl sulphonylbenzene PubChem CID: 736143 IUPAC Name: [(E)-2-(benzenesulfonyl)ethenyl]benzene SMILES: C1=CC=C(C=C1)C=CS(=O)(=O)C2=CC=CC=C2

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PubChem CID	736143
CAS	16212-06-9
Molecular Weight (g/mol)	244.308
MDL Number	MFCD00159177
SMILES	C1=CC=C(C=C1)C=CS(=O)(=O)C2=CC=CC=C2
Synonym	phenyl trans-styryl sulfone,phenyl styryl sulfone,sulfone, phenyl styryl,phenyl trans-styryl sulphone,phenyl 2-phenylvinyl sulfone,benzene, 2-phenylethenyl sulfonyl,e-2-benzenesulfonyl ethenyl benzene,1e-2-phenylvinyl sulfonyl benzene,styrylsulfonylbenzene,e-2-phenylethenyl sulphonylbenzene
IUPAC Name	[(E)-2-(benzenesulfonyl)ethenyl]benzene
InChI Key	DNMCCXFLTURVLK-VAWYXSNFSA-N
Molecular Formula	C14H12O2S

Phenyl sulfone, 97%

CAS: 127-63-9 Molecular Formula: C12H10O2S Molecular Weight (g/mol): 218.27 MDL Number: MFCD00007548 InChI Key: KZTYYGOKRVBIMI-UHFFFAOYSA-N Synonym: diphenyl sulfone,phenyl sulfone,sulfonyldibenzene,diphenylsulfone,sulfobenzide,diphenyl sulphone,benzene, 1,1'-sulfonylbis,sulfone, diphenyl,1,1'-sulfonyldibenzene,phenyl sulphone PubChem CID: 31386 ChEBI: CHEBI:78360 SMILES: O=S(=O)(C1=CC=CC=C1)C1=CC=CC=C1

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PubChem CID	31386
CAS	127-63-9
Molecular Weight (g/mol)	218.27
ChEBI	CHEBI:78360
MDL Number	MFCD00007548
SMILES	O=S(=O)(C1=CC=CC=C1)C1=CC=CC=C1
Synonym	diphenyl sulfone,phenyl sulfone,sulfonyldibenzene,diphenylsulfone,sulfobenzide,diphenyl sulphone,benzene, 1,1'-sulfonylbis,sulfone, diphenyl,1,1'-sulfonyldibenzene,phenyl sulphone
InChI Key	KZTYYGOKRVBIMI-UHFFFAOYSA-N
Molecular Formula	C12H10O2S

Thiamphenicol

CAS: 15318-45-3 Molecular Formula: C12H15Cl2NO5S Molecular Weight (g/mol): 356.214 MDL Number: MFCD00467983 InChI Key: OTVAEFIXJLOWRX-NXEZZACHSA-N Synonym: thiamphenicol,thiophenicol,thiamcol,+-thiamphenicol,raceophenidol,thiocymetin,dextrosulphenidol,thiamphenicolum,d-thiocymetin,d-thiophenicol PubChem CID: 27200 ChEBI: CHEBI:32215 IUPAC Name: 2,2-dichloro-N-[(1R,2R)-1,3-dihydroxy-1-(4-methylsulfonylphenyl)propan-2-yl]acetamide SMILES: CS(=O)(=O)C1=CC=C(C=C1)C(C(CO)NC(=O)C(Cl)Cl)O

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PubChem CID	27200
CAS	15318-45-3
Molecular Weight (g/mol)	356.214
ChEBI	CHEBI:32215
MDL Number	MFCD00467983
SMILES	CS(=O)(=O)C1=CC=C(C=C1)C(C(CO)NC(=O)C(Cl)Cl)O
Synonym	thiamphenicol,thiophenicol,thiamcol,+-thiamphenicol,raceophenidol,thiocymetin,dextrosulphenidol,thiamphenicolum,d-thiocymetin,d-thiophenicol
IUPAC Name	2,2-dichloro-N-[(1R,2R)-1,3-dihydroxy-1-(4-methylsulfonylphenyl)propan-2-yl]acetamide
InChI Key	OTVAEFIXJLOWRX-NXEZZACHSA-N
Molecular Formula	C12H15Cl2NO5S

4-Methylsulphonyl benzonitrile, 95%, Thermo Scientific™

CAS: 22821-76-7 Molecular Formula: C8H7NO2S Molecular Weight (g/mol): 181.21 MDL Number: MFCD00216489 InChI Key: FARXIDYHJAANGP-UHFFFAOYSA-N Synonym: 4-methylsulfonyl benzonitrile,4-methanesulfonyl-benzonitrile,4-methanesulfonylbenzonitrile,benzonitrile, 4-methylsulfonyl,benzonitrile, p-methylsulfonyl,4-methylsulfonyl benzenecarbonitrile,4-mesylbenzonitrile,maybridge3_003168,p-methylsulfonylbenzonitrile,4-methylsulphonylbenzonitrile PubChem CID: 519981 IUPAC Name: 4-methylsulfonylbenzonitrile SMILES: CS(=O)(=O)C1=CC=C(C=C1)C#N

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PubChem CID	519981
CAS	22821-76-7
Molecular Weight (g/mol)	181.21
MDL Number	MFCD00216489
SMILES	CS(=O)(=O)C1=CC=C(C=C1)C#N
Synonym	4-methylsulfonyl benzonitrile,4-methanesulfonyl-benzonitrile,4-methanesulfonylbenzonitrile,benzonitrile, 4-methylsulfonyl,benzonitrile, p-methylsulfonyl,4-methylsulfonyl benzenecarbonitrile,4-mesylbenzonitrile,maybridge3_003168,p-methylsulfonylbenzonitrile,4-methylsulphonylbenzonitrile
IUPAC Name	4-methylsulfonylbenzonitrile
InChI Key	FARXIDYHJAANGP-UHFFFAOYSA-N
Molecular Formula	C8H7NO2S

4-Fluorophenyl sulfone, 99%

CAS: 383-29-9 Molecular Formula: C12H8F2O2S Molecular Weight (g/mol): 254.25 MDL Number: MFCD00000350 InChI Key: PLVUIVUKKJTSDM-UHFFFAOYSA-N Synonym: 4-fluorophenyl sulfone,bis p-fluorophenyl sulfone,4,4'-sulfonylbis fluorobenzene,bis 4-fluorophenyl sulfone,4,4'-difluorodiphenyl sulfone,4-fluorophenyl sulphone,4-fluorophenylsulfone,benzene, 1,1'-sulfonylbis 4-fluoro,4,4'-difluorodiphenyl sulphone PubChem CID: 67842 IUPAC Name: 1-fluoro-4-(4-fluorophenyl)sulfonylbenzene SMILES: FC1=CC=C(C=C1)S(=O)(=O)C1=CC=C(F)C=C1

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PubChem CID	67842
CAS	383-29-9
Molecular Weight (g/mol)	254.25
MDL Number	MFCD00000350
SMILES	FC1=CC=C(C=C1)S(=O)(=O)C1=CC=C(F)C=C1
Synonym	4-fluorophenyl sulfone,bis p-fluorophenyl sulfone,4,4'-sulfonylbis fluorobenzene,bis 4-fluorophenyl sulfone,4,4'-difluorodiphenyl sulfone,4-fluorophenyl sulphone,4-fluorophenylsulfone,benzene, 1,1'-sulfonylbis 4-fluoro,4,4'-difluorodiphenyl sulphone
IUPAC Name	1-fluoro-4-(4-fluorophenyl)sulfonylbenzene
InChI Key	PLVUIVUKKJTSDM-UHFFFAOYSA-N
Molecular Formula	C12H8F2O2S

Thiamphenicol, 98%, Thermo Scientific Chemicals

CAS: 15318-45-3 Molecular Formula: C₁₂H₁₅ClNO₅S Molecular Weight (g/mol): 356.22 InChI Key: OTVAEFIXJLOWRX-NXEZZACHSA-N Synonym: thiamphenicol,thiophenicol,thiamcol,+-thiamphenicol,raceophenidol,thiocymetin,dextrosulphenidol,thiamphenicolum,d-thiocymetin,d-thiophenicol PubChem CID: 27200 ChEBI: CHEBI:32215 IUPAC Name: 2,2-dichloro-N-[(1R,2R)-1,3-dihydroxy-1-(4-methylsulfonylphenyl)propan-2-yl]acetamide SMILES: CS(=O)(=O)C1=CC=C(C=C1)C(C(CO)NC(=O)C(Cl)Cl)O

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Specifications

PubChem CID	27200
CAS	15318-45-3
Molecular Weight (g/mol)	356.22
ChEBI	CHEBI:32215
SMILES	CS(=O)(=O)C1=CC=C(C=C1)C(C(CO)NC(=O)C(Cl)Cl)O
Synonym	thiamphenicol,thiophenicol,thiamcol,+-thiamphenicol,raceophenidol,thiocymetin,dextrosulphenidol,thiamphenicolum,d-thiocymetin,d-thiophenicol
IUPAC Name	2,2-dichloro-N-[(1R,2R)-1,3-dihydroxy-1-(4-methylsulfonylphenyl)propan-2-yl]acetamide
InChI Key	OTVAEFIXJLOWRX-NXEZZACHSA-N
Molecular Formula	C₁₂H₁₅ClNO₅S

Benzenesulfonyl compounds

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