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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Tetrahydrothiophene, 98%

CAS: 110-01-0 Molecular Formula: C4H8S Molecular Weight (g/mol): 88.17 MDL Number: MFCD00005476 InChI Key: RAOIDOHSFRTOEL-UHFFFAOYSA-N Synonym: tetrahydrothiophene,thiophene, tetrahydro,thiophane,thiacyclopentane,tetramethylene sulfide,thilane,tetrahydrothiophen,pennodorant 1013,thiofan,thiolan PubChem CID: 1127 ChEBI: CHEBI:48458 IUPAC Name: thiolane SMILES: C1CCSC1

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PubChem CID	1127
CAS	110-01-0
Molecular Weight (g/mol)	88.17
ChEBI	CHEBI:48458
MDL Number	MFCD00005476
SMILES	C1CCSC1
Synonym	tetrahydrothiophene,thiophene, tetrahydro,thiophane,thiacyclopentane,tetramethylene sulfide,thilane,tetrahydrothiophen,pennodorant 1013,thiofan,thiolan
IUPAC Name	thiolane
InChI Key	RAOIDOHSFRTOEL-UHFFFAOYSA-N
Molecular Formula	C4H8S

2,2'-Thiodiethanethiol, tech. 85%

CAS: 3570-55-6 Molecular Formula: C4H10S3 Molecular Weight (g/mol): 154.30 MDL Number: MFCD00004893 InChI Key: KSJBMDCFYZKAFH-UHFFFAOYSA-N Synonym: 2,2'-thiodiethanethiol,bis 2-mercaptoethyl sulfide,2-mercaptoethyl sulfide,ethanethiol, 2,2'-thiobis,bis mercaptoethyl sulfide,3-thia-1,5-pentanedithiol,2-mercaptoethylsulfide,2,2'-dimercaptodiethyl sulfide,unii-oeu4azc07s,ethanethiol, 2,2'-thiodi PubChem CID: 77117 SMILES: SCCSCCS

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PubChem CID	77117
CAS	3570-55-6
Molecular Weight (g/mol)	154.30
MDL Number	MFCD00004893
SMILES	SCCSCCS
Synonym	2,2'-thiodiethanethiol,bis 2-mercaptoethyl sulfide,2-mercaptoethyl sulfide,ethanethiol, 2,2'-thiobis,bis mercaptoethyl sulfide,3-thia-1,5-pentanedithiol,2-mercaptoethylsulfide,2,2'-dimercaptodiethyl sulfide,unii-oeu4azc07s,ethanethiol, 2,2'-thiodi
InChI Key	KSJBMDCFYZKAFH-UHFFFAOYSA-N
Molecular Formula	C4H10S3

1-Methylthio-2-propanone, 98+%

CAS: 14109-72-9 Molecular Formula: C4H8OS Molecular Weight (g/mol): 104.17 MDL Number: MFCD00015325 InChI Key: UKFADLGENFFWHR-UHFFFAOYSA-N Synonym: 1-methylthio-2-propanone,methylthio acetone,2-thia-4-pentanone,unii-s6v0dw7bqa,1-methylsulfanyl propan-2-one,2-propanone, 1-methylthio,methylthio-2-propanone,acetonyl methyl sulfide,1-methylsulfanyl acetone,s6v0dw7bqa PubChem CID: 6430713 IUPAC Name: 1-methylsulfanylpropan-2-one SMILES: CSCC(C)=O

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PubChem CID	6430713
CAS	14109-72-9
Molecular Weight (g/mol)	104.17
MDL Number	MFCD00015325
SMILES	CSCC(C)=O
Synonym	1-methylthio-2-propanone,methylthio acetone,2-thia-4-pentanone,unii-s6v0dw7bqa,1-methylsulfanyl propan-2-one,2-propanone, 1-methylthio,methylthio-2-propanone,acetonyl methyl sulfide,1-methylsulfanyl acetone,s6v0dw7bqa
IUPAC Name	1-methylsulfanylpropan-2-one
InChI Key	UKFADLGENFFWHR-UHFFFAOYSA-N
Molecular Formula	C4H8OS

Di-n-pentyl sulfide, 97%

CAS: 872-10-6 Molecular Formula: C10H22S Molecular Weight (g/mol): 174.35 MDL Number: MFCD00027275 InChI Key: JOZDADPMWLVEJK-UHFFFAOYSA-N Synonym: pentyl sulfide,diamyl sulfide,pentane, 1,1'-thiobis,amyl sulfide,n-amyl sulfide,dipentyl sulphide,di-n-pentyl sulfide,dipentyl sulfide,unii-61xjn3644r,di-n-pentyl sulphide PubChem CID: 13382 IUPAC Name: 1-pentylsulfanylpentane SMILES: CCCCCSCCCCC

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PubChem CID	13382
CAS	872-10-6
Molecular Weight (g/mol)	174.35
MDL Number	MFCD00027275
SMILES	CCCCCSCCCCC
Synonym	pentyl sulfide,diamyl sulfide,pentane, 1,1'-thiobis,amyl sulfide,n-amyl sulfide,dipentyl sulphide,di-n-pentyl sulfide,dipentyl sulfide,unii-61xjn3644r,di-n-pentyl sulphide
IUPAC Name	1-pentylsulfanylpentane
InChI Key	JOZDADPMWLVEJK-UHFFFAOYSA-N
Molecular Formula	C10H22S

Bis(methylthio)methane, 99%

CAS: 1618-26-4 Molecular Formula: C3H8S2 Molecular Weight (g/mol): 108.217 MDL Number: MFCD00008564 InChI Key: LOCDPORVFVOGCR-UHFFFAOYSA-N Synonym: bis methylthio methane,bis methylsulfanyl methane,2,4-dithiapentane,methane, bis methylthio,bis methylmercapto methane,formaldehyde dimethyl mercaptal,methylenebis methyl sulfide,thioformaldehyde dimethylacetal,ch3sch2sch3 PubChem CID: 15380 IUPAC Name: bis(methylsulfanyl)methane SMILES: CSCSC

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PubChem CID	15380
CAS	1618-26-4
Molecular Weight (g/mol)	108.217
MDL Number	MFCD00008564
SMILES	CSCSC
Synonym	bis methylthio methane,bis methylsulfanyl methane,2,4-dithiapentane,methane, bis methylthio,bis methylmercapto methane,formaldehyde dimethyl mercaptal,methylenebis methyl sulfide,thioformaldehyde dimethylacetal,ch3sch2sch3
IUPAC Name	bis(methylsulfanyl)methane
InChI Key	LOCDPORVFVOGCR-UHFFFAOYSA-N
Molecular Formula	C3H8S2

3-(Phenylthio)thiophene, 97%

CAS: 16718-11-9 Molecular Formula: C10H8S2 Molecular Weight (g/mol): 192.29 MDL Number: MFCD00052043 InChI Key: WQYNBKIZHCGYCV-UHFFFAOYSA-N Synonym: 3-phenylthio thiophene,3-phenylsulfanyl thiophene,thiophene,3-phenylthio,3-phenylthiothiophene,acmc-1bt9i,3-phenylsulphanyl thiophene,phenyl-3-thienyl-sulphide PubChem CID: 2778902 IUPAC Name: 3-phenylsulfanylthiophene SMILES: S(C1=CSC=C1)C1=CC=CC=C1

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PubChem CID	2778902
CAS	16718-11-9
Molecular Weight (g/mol)	192.29
MDL Number	MFCD00052043
SMILES	S(C1=CSC=C1)C1=CC=CC=C1
Synonym	3-phenylthio thiophene,3-phenylsulfanyl thiophene,thiophene,3-phenylthio,3-phenylthiothiophene,acmc-1bt9i,3-phenylsulphanyl thiophene,phenyl-3-thienyl-sulphide
IUPAC Name	3-phenylsulfanylthiophene
InChI Key	WQYNBKIZHCGYCV-UHFFFAOYSA-N
Molecular Formula	C10H8S2

Methyl sulfide, 99+%, extra pure

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

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

Phenyl sulfide, 99%

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

2-[3-Methyl-4-(2,2,2-trifluoroethoxy)-2-pyridylmethylthio]-1H-benzimidazole, 98%

CAS: 103577-40-8 Molecular Formula: C16H14F3N3OS Molecular Weight (g/mol): 353.363 MDL Number: MFCD00834357 InChI Key: CCHLMSUZHFPSFC-UHFFFAOYSA-N Synonym: lansoprazole sulfide,2-3-methyl-4-2,2,2-trifluoroethoxy pyridin-2-yl methyl thio-1h-benzo d imidazole,2-3-methyl-4-2,2,2-trifluoroethoxy-2-pyridinyl methylthio-1h-benzimidazole,unii-58xp950e2t,lansoprazole sulphide compound,2-3-methyl-4-2,2,2-trifluoroethoxy-2-pyridinyl methyl thio-1h-benzimidazole,2-methyl-4-2,2,2-trifluoroethoxy pyridinyl thio-1h-binzimidazole,1h-benzimidazole,2-3-methyl-4-2,2,2-trifluoroethoxy-2-pyridinyl methyl thio,2-3-methyl-4-2,2,2-trifluoroethoxy pyridin-2-yl methyl sulfanyl-1h-1,3-benzodiazole,2-3-methyl-4-2,2,2-trifluoroethoxy pyridinyl methyl thio-1h-benzimidazole PubChem CID: 1094080 IUPAC Name: 2-[[3-methyl-4-(2,2,2-trifluoroethoxy)pyridin-2-yl]methylsulfanyl]-1H-benzimidazole SMILES: CC1=C(C=CN=C1CSC2=NC3=CC=CC=C3N2)OCC(F)(F)F

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PubChem CID	1094080
CAS	103577-40-8
Molecular Weight (g/mol)	353.363
MDL Number	MFCD00834357
SMILES	CC1=C(C=CN=C1CSC2=NC3=CC=CC=C3N2)OCC(F)(F)F
Synonym	lansoprazole sulfide,2-3-methyl-4-2,2,2-trifluoroethoxy pyridin-2-yl methyl thio-1h-benzo d imidazole,2-3-methyl-4-2,2,2-trifluoroethoxy-2-pyridinyl methylthio-1h-benzimidazole,unii-58xp950e2t,lansoprazole sulphide compound,2-3-methyl-4-2,2,2-trifluoroethoxy-2-pyridinyl methyl thio-1h-benzimidazole,2-methyl-4-2,2,2-trifluoroethoxy pyridinyl thio-1h-binzimidazole,1h-benzimidazole,2-3-methyl-4-2,2,2-trifluoroethoxy-2-pyridinyl methyl thio,2-3-methyl-4-2,2,2-trifluoroethoxy pyridin-2-yl methyl sulfanyl-1h-1,3-benzodiazole,2-3-methyl-4-2,2,2-trifluoroethoxy pyridinyl methyl thio-1h-benzimidazole
IUPAC Name	2-[[3-methyl-4-(2,2,2-trifluoroethoxy)pyridin-2-yl]methylsulfanyl]-1H-benzimidazole
InChI Key	CCHLMSUZHFPSFC-UHFFFAOYSA-N
Molecular Formula	C16H14F3N3OS

Flupentixol dihydrochloride, Thermo Scientific Chemicals

CAS: 2413-38-9 Molecular Weight (g/mol): 507.44 InChI Key: IOVDQEIIMOZNNA-MHKBYHAFSA-N IUPAC Name: dihydrogen 2-(4-{3-[(9Z)-2-(trifluoromethyl)-9H-thioxanthen-9-ylidene]propyl}piperazin-1-yl)ethan-1-ol dichloride SMILES: [H+].[H+].[Cl-].[Cl-].OCCN1CCN(CC\C=C2\C3=CC=CC=C3SC3=CC=C(C=C23)C(F)(F)F)CC1

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CAS	2413-38-9
Molecular Weight (g/mol)	507.44
SMILES	[H+].[H+].[Cl-].[Cl-].OCCN1CCN(CC\C=C2\C3=CC=CC=C3SC3=CC=C(C=C23)C(F)(F)F)CC1
IUPAC Name	dihydrogen 2-(4-{3-[(9Z)-2-(trifluoromethyl)-9H-thioxanthen-9-ylidene]propyl}piperazin-1-yl)ethan-1-ol dichloride
InChI Key	IOVDQEIIMOZNNA-MHKBYHAFSA-N

Diisopropyl sulfide, 99%

CAS: 625-80-9 Molecular Formula: C6H14S Molecular Weight (g/mol): 118.24 MDL Number: MFCD00008895 InChI Key: XYWDPYKBIRQXQS-UHFFFAOYSA-N Synonym: diisopropyl sulfide,isopropyl sulfide,propane, 2,2'-thiobis,2,4-dimethyl-3-thiapentane,isopropyl sulphide,diisopropyl sulphide,2,2'-thiodipropane,2-isopropylsulfanyl propane,2-propan-2-ylsulfanyl propane,isopropylsulfide PubChem CID: 12264 SMILES: CC(C)SC(C)C

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PubChem CID	12264
CAS	625-80-9
Molecular Weight (g/mol)	118.24
MDL Number	MFCD00008895
SMILES	CC(C)SC(C)C
Synonym	diisopropyl sulfide,isopropyl sulfide,propane, 2,2'-thiobis,2,4-dimethyl-3-thiapentane,isopropyl sulphide,diisopropyl sulphide,2,2'-thiodipropane,2-isopropylsulfanyl propane,2-propan-2-ylsulfanyl propane,isopropylsulfide
InChI Key	XYWDPYKBIRQXQS-UHFFFAOYSA-N
Molecular Formula	C6H14S

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

Di-n-decyl sulfide, 97%

CAS: 693-83-4 Molecular Formula: C20H42S Molecular Weight (g/mol): 314.62 MDL Number: MFCD00026542 InChI Key: RKYMVQJWYYOIJB-UHFFFAOYSA-N Synonym: decyl sulfide,didecyl sulfide,di-n-decyl sulfide,decane, 1,1'-thiobis,n-decyl sulfide,11-thiaheneicosane,decylthiodecane,didecyl sulphide,di-n-decylsulfide,decane,1'-thiobis PubChem CID: 69662 IUPAC Name: 1-decylsulfanyldecane SMILES: CCCCCCCCCCSCCCCCCCCCC

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PubChem CID	69662
CAS	693-83-4
Molecular Weight (g/mol)	314.62
MDL Number	MFCD00026542
SMILES	CCCCCCCCCCSCCCCCCCCCC
Synonym	decyl sulfide,didecyl sulfide,di-n-decyl sulfide,decane, 1,1'-thiobis,n-decyl sulfide,11-thiaheneicosane,decylthiodecane,didecyl sulphide,di-n-decylsulfide,decane,1'-thiobis
IUPAC Name	1-decylsulfanyldecane
InChI Key	RKYMVQJWYYOIJB-UHFFFAOYSA-N
Molecular Formula	C20H42S

4-Methyl-2-(methylthio)pyrimidine, 98%, Thermo Scientific Chemicals

CAS: 14001-63-9 Molecular Formula: C6H8N2S Molecular Weight (g/mol): 140.204 MDL Number: MFCD00023242 InChI Key: UCERVHYBSTYCQS-UHFFFAOYSA-N Synonym: 4-methyl-2-methylthio pyrimidine,4-methyl-2 methylsulfanyl pyrimidine,4-methyl-2-methylsulfanyl pyrimidine,pyrimidine, 4-methyl-2-methylthio,4-methyl-2-methylsulfanyl-pyrimidine,2-methylthio-4-methylpyrimidine,4-methyl-2-methylthiopyrimidine,4-methyl-2-methylsulphanyl pyrimidine,acmc-1bust,methylmethylsulfanylpyrimidine PubChem CID: 821261 IUPAC Name: 4-methyl-2-methylsulfanylpyrimidine SMILES: CC1=NC(=NC=C1)SC

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PubChem CID	821261
CAS	14001-63-9
Molecular Weight (g/mol)	140.204
MDL Number	MFCD00023242
SMILES	CC1=NC(=NC=C1)SC
Synonym	4-methyl-2-methylthio pyrimidine,4-methyl-2 methylsulfanyl pyrimidine,4-methyl-2-methylsulfanyl pyrimidine,pyrimidine, 4-methyl-2-methylthio,4-methyl-2-methylsulfanyl-pyrimidine,2-methylthio-4-methylpyrimidine,4-methyl-2-methylthiopyrimidine,4-methyl-2-methylsulphanyl pyrimidine,acmc-1bust,methylmethylsulfanylpyrimidine
IUPAC Name	4-methyl-2-methylsulfanylpyrimidine
InChI Key	UCERVHYBSTYCQS-UHFFFAOYSA-N
Molecular Formula	C6H8N2S

Diethyl sulfide, 96%

CAS: 352-93-2 Molecular Formula: C4H10S Molecular Weight (g/mol): 90.18 MDL Number: MFCD00009270 InChI Key: LJSQFQKUNVCTIA-UHFFFAOYSA-N Synonym: diethyl sulfide,ethyl sulfide,ethyl thioether,3-thiapentane,diethylthioether,thioethyl ether,ethylthioethane,1,1'-thiobisethane,diethyl sulphide,ethane, 1,1'-thiobis PubChem CID: 9609 ChEBI: CHEBI:27710 IUPAC Name: ethylsulfanylethane SMILES: CCSCC

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PubChem CID	9609
CAS	352-93-2
Molecular Weight (g/mol)	90.18
ChEBI	CHEBI:27710
MDL Number	MFCD00009270
SMILES	CCSCC
Synonym	diethyl sulfide,ethyl sulfide,ethyl thioether,3-thiapentane,diethylthioether,thioethyl ether,ethylthioethane,1,1'-thiobisethane,diethyl sulphide,ethane, 1,1'-thiobis
IUPAC Name	ethylsulfanylethane
InChI Key	LJSQFQKUNVCTIA-UHFFFAOYSA-N
Molecular Formula	C4H10S

Thioethers

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