Thioethers

Organosulfur compounds that contain a carbon atom bonded to a sulfur atom that is bonded to a carbon atom in the following structure: C-S-C. Thioethers are considered the sulfur analog of the ether functional group.

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n-Butyl sulfide, 99%, pure

CAS: 544-40-1 Formula molecolare: C8H18S Molecular Weight (g/mol): 146.29 Numero MDL: MFCD00009468 InChI Key: HTIRHQRTDBPHNZ-UHFFFAOYSA-N Sinonimo: dibutyl sulfide,butyl sulfide,n-butyl sulfide,butylthiobutane,di-n-butyl sulfide,butane, 1,1'-thiobis,butyl monosulfide,dibutyl thioether,thiononane-5,n-dibutyl sulfide PubChem CID: 11002 SMILES: CCCCSCCCC

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Sinonimo	dibutyl sulfide,butyl sulfide,n-butyl sulfide,butylthiobutane,di-n-butyl sulfide,butane, 1,1'-thiobis,butyl monosulfide,dibutyl thioether,thiononane-5,n-dibutyl sulfide
Numero MDL	MFCD00009468
PubChem CID	11002
Formula molecolare	C8H18S
CAS	544-40-1
Molecular Weight (g/mol)	146.29
SMILES	CCCCSCCCC
InChI Key	HTIRHQRTDBPHNZ-UHFFFAOYSA-N

Phenyl sulfide, 99%

CAS: 139-66-2 Formula molecolare: C12H10S Molecular Weight (g/mol): 186.27 Numero MDL: MFCD00003064 InChI Key: LTYMSROWYAPPGB-UHFFFAOYSA-N Sinonimo: diphenyl sulfide,phenyl sulfide,phenylthiobenzene,diphenyl sulphide,diphenyl thioether,benzene, 1,1'-thiobis,diphenylmercaptan,diphenylthiamethane,diphenyl monosulfide,sulfide, diphenyl PubChem CID: 8766 ChEBI: CHEBI:38959 IUPAC Name: phenylsulfanylbenzene SMILES: S(C1=CC=CC=C1)C1=CC=CC=C1

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Sinonimo	diphenyl sulfide,phenyl sulfide,phenylthiobenzene,diphenyl sulphide,diphenyl thioether,benzene, 1,1'-thiobis,diphenylmercaptan,diphenylthiamethane,diphenyl monosulfide,sulfide, diphenyl
Numero MDL	MFCD00003064
PubChem CID	8766
Formula molecolare	C12H10S
CAS	139-66-2
Molecular Weight (g/mol)	186.27
ChEBI	CHEBI:38959
SMILES	S(C1=CC=CC=C1)C1=CC=CC=C1
IUPAC Name	phenylsulfanylbenzene
InChI Key	LTYMSROWYAPPGB-UHFFFAOYSA-N

Cyclohexyl methyl sulfide, 97%

CAS: 7133-37-1 Formula molecolare: C7H14S Molecular Weight (g/mol): 130.25 Numero MDL: MFCD00039460 InChI Key: QQBIOCGHCKNYGP-UHFFFAOYSA-N Sinonimo: cyclohexyl methyl sulfide,methylthio cyclohexane,sulfide, cyclohexyl methyl,cyclohexane, methylthio,methylthiocyclohexane,methylcyclohexylsulfide,cyclohexylmethylsulphide,cyclohexyl methylsulfide,methyl cyclohexyl sulfide,methylsulfanyl cyclohexane PubChem CID: 81553 SMILES: CSC1CCCCC1

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Sinonimo	cyclohexyl methyl sulfide,methylthio cyclohexane,sulfide, cyclohexyl methyl,cyclohexane, methylthio,methylthiocyclohexane,methylcyclohexylsulfide,cyclohexylmethylsulphide,cyclohexyl methylsulfide,methyl cyclohexyl sulfide,methylsulfanyl cyclohexane
Numero MDL	MFCD00039460
PubChem CID	81553
Formula molecolare	C7H14S
CAS	7133-37-1
Molecular Weight (g/mol)	130.25
SMILES	CSC1CCCCC1
InChI Key	QQBIOCGHCKNYGP-UHFFFAOYSA-N

Dimethyl sulfide, 99+%

CAS: 75-18-3 Formula molecolare: C2H6S Molecular Weight (g/mol): 62.13 Numero MDL: MFCD00008562 InChI Key: QMMFVYPAHWMCMS-UHFFFAOYSA-N Sinonimo: dimethyl sulfide,methyl sulfide,methane, thiobis,dimethylsulfide,dimethylsulphide,methyl thioether,2-thiapropane,dimethyl sulphide,dimethyl thioether,methylthiomethane PubChem CID: 1068 ChEBI: CHEBI:17437 SMILES: CSC

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Sinonimo	dimethyl sulfide,methyl sulfide,methane, thiobis,dimethylsulfide,dimethylsulphide,methyl thioether,2-thiapropane,dimethyl sulphide,dimethyl thioether,methylthiomethane
Numero MDL	MFCD00008562
PubChem CID	1068
Formula molecolare	C2H6S
CAS	75-18-3
Molecular Weight (g/mol)	62.13
ChEBI	CHEBI:17437
SMILES	CSC
InChI Key	QMMFVYPAHWMCMS-UHFFFAOYSA-N

Sinonimo	dimethyl sulfide,methyl sulfide,methane, thiobis,dimethylsulfide,dimethylsulphide,methyl thioether,2-thiapropane,dimethyl sulphide,dimethyl thioether,methylthiomethane
Numero MDL	MFCD00008562
PubChem CID	1068
Formula molecolare	C2H6S
CAS	75-18-3
Molecular Weight (g/mol)	62.13
ChEBI	CHEBI:17437
SMILES	CSC
IUPAC Name	methylsulfanylmethane
InChI Key	QMMFVYPAHWMCMS-UHFFFAOYSA-N

3,3'-Thiodipropionic acid, 99%

CAS: 111-17-1 Formula molecolare: C₆H₁₀O₄S Molecular Weight (g/mol): 178.2 Numero MDL: MFCD00002781 InChI Key: ODJQKYXPKWQWNK-UHFFFAOYSA-N Sinonimo: 3,3'-thiodipropionic acid,thiodipropionic acid,propanoic acid, 3,3'-thiobis,bis 2-carboxyethyl sulfide,tyox a,thiodihydracrylic acid,4-thiaheptanedioic acid,tdpa,sulfide, bis 2-carboxyethyl,3,3'-thiodipropanoic acid PubChem CID: 8096 IUPAC Name: 3-(2-carboxyethylsulfanyl)propanoic acid SMILES: C(CSCCC(=O)O)C(=O)O

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Sinonimo	3,3'-thiodipropionic acid,thiodipropionic acid,propanoic acid, 3,3'-thiobis,bis 2-carboxyethyl sulfide,tyox a,thiodihydracrylic acid,4-thiaheptanedioic acid,tdpa,sulfide, bis 2-carboxyethyl,3,3'-thiodipropanoic acid
Numero MDL	MFCD00002781
PubChem CID	8096
Formula molecolare	C₆H₁₀O₄S
CAS	111-17-1
Molecular Weight (g/mol)	178.2
SMILES	C(CSCCC(=O)O)C(=O)O
IUPAC Name	3-(2-carboxyethylsulfanyl)propanoic acid
InChI Key	ODJQKYXPKWQWNK-UHFFFAOYSA-N

Di-2-thienyl sulfide, 97%

CAS: 3988-99-6 Formula molecolare: C8H6S3 Molecular Weight (g/mol): 198.32 Numero MDL: MFCD00052047 InChI Key: AKYIWBKPINOXJY-UHFFFAOYSA-N Sinonimo: 2-2-thienylthio thiophene,thiophene, 2,2'-thiobis,thiophene,2,2'-thiobis,2-2-thienylsulfanyl thiophene,2-thiophen-2-ylsulfanyl thiophene,2-thienyl sulfide,di-2-thienyl sulfide,2,2'-thiobisthiophene,di 2-thienyl sulphide PubChem CID: 138094 IUPAC Name: 2-thiophen-2-ylsulfanylthiophene SMILES: S(C1=CC=CS1)C1=CC=CS1

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Sinonimo	2-2-thienylthio thiophene,thiophene, 2,2'-thiobis,thiophene,2,2'-thiobis,2-2-thienylsulfanyl thiophene,2-thiophen-2-ylsulfanyl thiophene,2-thienyl sulfide,di-2-thienyl sulfide,2,2'-thiobisthiophene,di 2-thienyl sulphide
Numero MDL	MFCD00052047
PubChem CID	138094
Formula molecolare	C8H6S3
CAS	3988-99-6
Molecular Weight (g/mol)	198.32
SMILES	S(C1=CC=CS1)C1=CC=CS1
IUPAC Name	2-thiophen-2-ylsulfanylthiophene
InChI Key	AKYIWBKPINOXJY-UHFFFAOYSA-N

Epithiochlorohydrine, 97%

CAS: 3221-15-6 Formula molecolare: C₃H₅ClS Molecular Weight (g/mol): 108.59 Numero MDL: MFCD00041199 InChI Key: XRWMHJJHPQTTLQ-UHFFFAOYSA-N Sinonimo: 2-chloromethyl thiirane,thioepichlorohydrin,epithiochlorohydrin,thioepichlorhydrin,chloropropylene sulfide,chloromethyl thiirane,3-chloropropylene sulfide,2-thiiranylmethyl chloride,thiirane, chloromethyl,chloropropylene sulphide PubChem CID: 18588 IUPAC Name: 2-(chloromethyl)thiirane SMILES: C1C(S1)CCl

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Sinonimo	2-chloromethyl thiirane,thioepichlorohydrin,epithiochlorohydrin,thioepichlorhydrin,chloropropylene sulfide,chloromethyl thiirane,3-chloropropylene sulfide,2-thiiranylmethyl chloride,thiirane, chloromethyl,chloropropylene sulphide
Numero MDL	MFCD00041199
PubChem CID	18588
Formula molecolare	C₃H₅ClS
CAS	3221-15-6
Molecular Weight (g/mol)	108.59
SMILES	C1C(S1)CCl
IUPAC Name	2-(chloromethyl)thiirane
InChI Key	XRWMHJJHPQTTLQ-UHFFFAOYSA-N

Di-n-butyl sulfide, 98%

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Sinonimo	dibutyl sulfide,butyl sulfide,n-butyl sulfide,butylthiobutane,di-n-butyl sulfide,butane, 1,1'-thiobis,butyl monosulfide,dibutyl thioether,thiononane-5,n-dibutyl sulfide
Numero MDL	MFCD00009468
PubChem CID	11002
Formula molecolare	C8H18S
CAS	544-40-1
Molecular Weight (g/mol)	146.29
SMILES	CCCCSCCCC
IUPAC Name	1-butylsulfanylbutane
InChI Key	HTIRHQRTDBPHNZ-UHFFFAOYSA-N

4-Nitrophenyl phenyl sulfide, 98%

CAS: 952-97-6 Formula molecolare: C12H9NO2S Molecular Weight (g/mol): 231.27 Numero MDL: MFCD00024700 InChI Key: RJCBYBQJVXVVKB-UHFFFAOYSA-N Sinonimo: 4-nitrophenyl phenyl sulfide,4-nitrodiphenyl sulfide,1-nitro-4-phenylsulfanyl benzene,p-nitrodiphenyl sulfide,p-nitrophenyl phenyl sulfide,4-nitrodiphenyl thioether,1-nitro-4-phenylthio benzene,phenyl p-nitrophenylsulfide,benzene, 1-nitro-4-phenylthio,sulfide, p-nitrophenyl phenyl PubChem CID: 13720 IUPAC Name: 1-nitro-4-phenylsulfanylbenzene SMILES: [O-][N+](=O)C1=CC=C(SC2=CC=CC=C2)C=C1

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Sinonimo	4-nitrophenyl phenyl sulfide,4-nitrodiphenyl sulfide,1-nitro-4-phenylsulfanyl benzene,p-nitrodiphenyl sulfide,p-nitrophenyl phenyl sulfide,4-nitrodiphenyl thioether,1-nitro-4-phenylthio benzene,phenyl p-nitrophenylsulfide,benzene, 1-nitro-4-phenylthio,sulfide, p-nitrophenyl phenyl
Numero MDL	MFCD00024700
PubChem CID	13720
Formula molecolare	C12H9NO2S
CAS	952-97-6
Molecular Weight (g/mol)	231.27
SMILES	[O-][N+](=O)C1=CC=C(SC2=CC=CC=C2)C=C1
IUPAC Name	1-nitro-4-phenylsulfanylbenzene
InChI Key	RJCBYBQJVXVVKB-UHFFFAOYSA-N

ethyle2-({[(2-ethoxy-2-oxoethyl)thio]methyl}thio)acetate, 97%, Thermo Scientific™

CAS: 61713-23-3 Formula molecolare: C9H16O4S2 Molecular Weight (g/mol): 252.343 Numero MDL: MFCD00026901 InChI Key: NBNGVIRHOBZBHM-UHFFFAOYSA-N Sinonimo: methylenebis ethyl thioglycolate,ethyl 2-2-ethoxy-2-oxoethyl thio methyl thio acetate,ethyl 2-2-ethoxy-2-oxoethyl sulfanyl methyl sulfanyl acetate,ethyl 2-ethoxy-2-oxoethyl sulfanyl methyl sulfanyl acetate,diethyl 2,2'-methylenedisulfanediyl diacetate,diethyl 2,2'-methylenebis sulfanediyl diacetate,ethyl 2-ethoxycarbonyl methylthio methylthio acetate,ethyl 2-2-ethoxy-2-oxoethyl sulfanylmethylsulfanyl acetate,aceticacid, 2,2'-methylenebis thio bis-, diethyl ester 9ci PubChem CID: 521987 IUPAC Name: ethyl 2-[(2-ethoxy-2-oxoethyl)sulfanylmethylsulfanyl]acetate SMILES: CCOC(=O)CSCSCC(=O)OCC

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Sinonimo	methylenebis ethyl thioglycolate,ethyl 2-2-ethoxy-2-oxoethyl thio methyl thio acetate,ethyl 2-2-ethoxy-2-oxoethyl sulfanyl methyl sulfanyl acetate,ethyl 2-ethoxy-2-oxoethyl sulfanyl methyl sulfanyl acetate,diethyl 2,2'-methylenedisulfanediyl diacetate,diethyl 2,2'-methylenebis sulfanediyl diacetate,ethyl 2-ethoxycarbonyl methylthio methylthio acetate,ethyl 2-2-ethoxy-2-oxoethyl sulfanylmethylsulfanyl acetate,aceticacid, 2,2'-methylenebis thio bis-, diethyl ester 9ci
Numero MDL	MFCD00026901
PubChem CID	521987
Formula molecolare	C9H16O4S2
CAS	61713-23-3
Molecular Weight (g/mol)	252.343
SMILES	CCOC(=O)CSCSCC(=O)OCC
IUPAC Name	ethyl 2-[(2-ethoxy-2-oxoethyl)sulfanylmethylsulfanyl]acetate
InChI Key	NBNGVIRHOBZBHM-UHFFFAOYSA-N

Ethyl methyl sulfide, 97%

CAS: 624-89-5 Formula molecolare: C3H8S Molecular Weight (g/mol): 76.16 Numero MDL: MFCD00009268 InChI Key: WXEHBUMAEPOYKP-UHFFFAOYSA-N Sinonimo: ethyl methyl sulfide,methylthioethane,ethane, methylthio,methyl ethyl sulfide,ethyl methyl sulphide,methyl ethyl sulphide,sulfide, ethyl methyl,unii-mr1gzs62tm,methylthio ethane,methylsulfanyl ethane PubChem CID: 12230 IUPAC Name: methylsulfanylethane SMILES: CCSC

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Sinonimo	ethyl methyl sulfide,methylthioethane,ethane, methylthio,methyl ethyl sulfide,ethyl methyl sulphide,methyl ethyl sulphide,sulfide, ethyl methyl,unii-mr1gzs62tm,methylthio ethane,methylsulfanyl ethane
Numero MDL	MFCD00009268
PubChem CID	12230
Formula molecolare	C3H8S
CAS	624-89-5
Molecular Weight (g/mol)	76.16
SMILES	CCSC
IUPAC Name	methylsulfanylethane
InChI Key	WXEHBUMAEPOYKP-UHFFFAOYSA-N

2-(Methylthio)ethylamine, 97%

CAS: 18542-42-2 Numero MDL: MFCD00014825 InChI Key: CYWGSFFHHMQKET-UHFFFAOYSA-N Sinonimo: 2-methylthio ethylamine,2-methylthio ethanamine,2-aminoethyl methyl sulfide,2-methylsulfanyl ethanamine,ethanamine, 2-methylthio,2-methylsulfanyl ethan-1-amine,2-methylthio ethyl amine,ethylamine, 2-methylthio,s-methylcysteamine PubChem CID: 87697 IUPAC Name: 2-methylsulfanylethanamine SMILES: CSCCN

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Sinonimo	2-methylthio ethylamine,2-methylthio ethanamine,2-aminoethyl methyl sulfide,2-methylsulfanyl ethanamine,ethanamine, 2-methylthio,2-methylsulfanyl ethan-1-amine,2-methylthio ethyl amine,ethylamine, 2-methylthio,s-methylcysteamine
Numero MDL	MFCD00014825
PubChem CID	87697
CAS	18542-42-2
SMILES	CSCCN
IUPAC Name	2-methylsulfanylethanamine
InChI Key	CYWGSFFHHMQKET-UHFFFAOYSA-N

2-Carboxymethylthio-4-methylpyrimidine, 98%, Thermo Scientific Chemicals

CAS: 46118-95-0 Formula molecolare: C7H8N2O2S Molecular Weight (g/mol): 184.213 Numero MDL: MFCD00023244 InChI Key: CGMJQRAIQBSTCC-UHFFFAOYSA-N Sinonimo: 2-carboxymethylthio-4-methylpyrimidine,4-methylpyrimidin-2-yl sulfanyl acetic acid,4-methylpyrimidin-2-yl thio acetic acid,2-4-methylpyrimidin-2-yl thio acetic acid,2-carboxymethylmercapto-4-methylpyrimidine,2-4-methylpyrimidin-2-yl sulfanyl acetic acid,2-4-methylpyrimidin-2-ylthio acetic acid,acmc-20aony,4-methyl-2-pyrimidinyl thio acetic acid PubChem CID: 98782 IUPAC Name: 2-(4-methylpyrimidin-2-yl)sulfanylacetic acid SMILES: CC1=NC(=NC=C1)SCC(=O)O

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Sinonimo	2-carboxymethylthio-4-methylpyrimidine,4-methylpyrimidin-2-yl sulfanyl acetic acid,4-methylpyrimidin-2-yl thio acetic acid,2-4-methylpyrimidin-2-yl thio acetic acid,2-carboxymethylmercapto-4-methylpyrimidine,2-4-methylpyrimidin-2-yl sulfanyl acetic acid,2-4-methylpyrimidin-2-ylthio acetic acid,acmc-20aony,4-methyl-2-pyrimidinyl thio acetic acid
Numero MDL	MFCD00023244
PubChem CID	98782
Formula molecolare	C7H8N2O2S
CAS	46118-95-0
Molecular Weight (g/mol)	184.213
SMILES	CC1=NC(=NC=C1)SCC(=O)O
IUPAC Name	2-(4-methylpyrimidin-2-yl)sulfanylacetic acid
InChI Key	CGMJQRAIQBSTCC-UHFFFAOYSA-N

4,6-Diamino-2-(methylthio)pyrimidine, 97%, Thermo Scientific Chemicals

CAS: 1005-39-6 Formula molecolare: C5H8N4S Molecular Weight (g/mol): 156.207 Numero MDL: MFCD00023241 InChI Key: AHAIUNAIAHSWPG-UHFFFAOYSA-N Sinonimo: 4,6-diamino-2-methylmercaptopyrimidine,2-methylthio pyrimidine-4,6-diamine,2-methylthiopyrimidine-4,6-diamine,4,6-diamino-2-methylthiopyrimidine,4,6-pyrimidinediamine, 2-methylthio,4,6-diamino-2-methylthio pyrimidine,2-methylsulfanyl pyrimidine-4,6-diamine,2-methylthio-4,6-diaminopyrimidine,4,6-diamino-2-methyl-mercaptopyrimidine,pyrimidine, 4,6-diamino-2-methylthio PubChem CID: 70497 IUPAC Name: 2-methylsulfanylpyrimidine-4,6-diamine SMILES: CSC1=NC(=CC(=N1)N)N

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Sinonimo	4,6-diamino-2-methylmercaptopyrimidine,2-methylthio pyrimidine-4,6-diamine,2-methylthiopyrimidine-4,6-diamine,4,6-diamino-2-methylthiopyrimidine,4,6-pyrimidinediamine, 2-methylthio,4,6-diamino-2-methylthio pyrimidine,2-methylsulfanyl pyrimidine-4,6-diamine,2-methylthio-4,6-diaminopyrimidine,4,6-diamino-2-methyl-mercaptopyrimidine,pyrimidine, 4,6-diamino-2-methylthio
Numero MDL	MFCD00023241
PubChem CID	70497
Formula molecolare	C5H8N4S
CAS	1005-39-6
Molecular Weight (g/mol)	156.207
SMILES	CSC1=NC(=CC(=N1)N)N
IUPAC Name	2-methylsulfanylpyrimidine-4,6-diamine
InChI Key	AHAIUNAIAHSWPG-UHFFFAOYSA-N

Thioethers

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