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Organosulfur Compounds

Organic compounds that contain one or more sulfur atoms, or sulfur-containing functional groups.
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Allyl phenyl sulfide, 97%, Thermo Scientific Chemicals

CAS: 5296-64-0 Molecular Formula: C9H10S Molecular Weight (g/mol): 150.24 MDL Number: MFCD00014957 InChI Key: QGNRLAFFKKBSIM-UHFFFAOYSA-N Synonym: allyl phenyl sulfide,allylthio benzene,allyl phenyl sulfane,benzene, 2-propenylthio,allylphenyl sulfide,phenyl allyl sulfide,allylphenylthioether,allyl phenyl ;sulfane,sulfide, allyl phenyl PubChem CID: 79180 IUPAC Name: prop-2-enylsulfanylbenzene SMILES: C=CCSC1=CC=CC=C1

PubChem CID 79180
CAS 5296-64-0
Molecular Weight (g/mol) 150.24
MDL Number MFCD00014957
SMILES C=CCSC1=CC=CC=C1
Synonym allyl phenyl sulfide,allylthio benzene,allyl phenyl sulfane,benzene, 2-propenylthio,allylphenyl sulfide,phenyl allyl sulfide,allylphenylthioether,allyl phenyl ;sulfane,sulfide, allyl phenyl
IUPAC Name prop-2-enylsulfanylbenzene
InChI Key QGNRLAFFKKBSIM-UHFFFAOYSA-N
Molecular Formula C9H10S
2
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Allyl ethyl sulfide, 97%

CAS: 5296-62-8 Molecular Formula: C5H10S Molecular Weight (g/mol): 102.20 MDL Number: MFCD00026979 InChI Key: NOJXPGXFDASWEI-UHFFFAOYSA-N Synonym: allyl ethyl sulfide,4-thia-1-hexene,1-propene-1-one, 3-ethylthio,allylethylsulfide,allyl ethylsulfide,allylethyl sulfide,allyl ethyl sulphide,3-ethylthio-1-propene,acmc-1ao1o PubChem CID: 123229 IUPAC Name: 3-ethylsulfanylprop-1-ene SMILES: CCSCC=C

PubChem CID 123229
CAS 5296-62-8
Molecular Weight (g/mol) 102.20
MDL Number MFCD00026979
SMILES CCSCC=C
Synonym allyl ethyl sulfide,4-thia-1-hexene,1-propene-1-one, 3-ethylthio,allylethylsulfide,allyl ethylsulfide,allylethyl sulfide,allyl ethyl sulphide,3-ethylthio-1-propene,acmc-1ao1o
IUPAC Name 3-ethylsulfanylprop-1-ene
InChI Key NOJXPGXFDASWEI-UHFFFAOYSA-N
Molecular Formula C5H10S
3
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Allyl mercaptan, tech., 70%, remainder mainly sulfide, Thermo Scientific Chemicals

CAS: 870-23-5 Molecular Formula: C3H6S Molecular Weight (g/mol): 74.14 MDL Number: MFCD00004894 InChI Key: ULIKDJVNUXNQHS-UHFFFAOYSA-N Synonym: allyl mercaptan,2-propene-1-thiol,allylthiol,allylmercaptan,allyl sulfhydrate,unii-1x587iby09,2-propenyl mercaptan,2-propenyl-1-thiol,ch2=chch2sh,allyl thiol PubChem CID: 13367 IUPAC Name: prop-2-ene-1-thiol SMILES: SCC=C

PubChem CID 13367
CAS 870-23-5
Molecular Weight (g/mol) 74.14
MDL Number MFCD00004894
SMILES SCC=C
Synonym allyl mercaptan,2-propene-1-thiol,allylthiol,allylmercaptan,allyl sulfhydrate,unii-1x587iby09,2-propenyl mercaptan,2-propenyl-1-thiol,ch2=chch2sh,allyl thiol
IUPAC Name prop-2-ene-1-thiol
InChI Key ULIKDJVNUXNQHS-UHFFFAOYSA-N
Molecular Formula C3H6S
4
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Allyl methyl sulfide, 98%

CAS: 10152-76-8 Molecular Formula: C4H8S Molecular Weight (g/mol): 88.17 MDL Number: MFCD00008657 InChI Key: NVLPQIPTCCLBEU-UHFFFAOYSA-N Synonym: allyl methyl sulfide,1-propene, 3-methylthio,allyl methyl sulphide,3-methylthio-1-propene,sulfide, allyl methyl,methyl propenyl sulfide,unii-v7qi1r316c,methyl allyl sulfide,ccris 7066 PubChem CID: 66282 IUPAC Name: 3-methylsulfanylprop-1-ene SMILES: CSCC=C

PubChem CID 66282
CAS 10152-76-8
Molecular Weight (g/mol) 88.17
MDL Number MFCD00008657
SMILES CSCC=C
Synonym allyl methyl sulfide,1-propene, 3-methylthio,allyl methyl sulphide,3-methylthio-1-propene,sulfide, allyl methyl,methyl propenyl sulfide,unii-v7qi1r316c,methyl allyl sulfide,ccris 7066
IUPAC Name 3-methylsulfanylprop-1-ene
InChI Key NVLPQIPTCCLBEU-UHFFFAOYSA-N
Molecular Formula C4H8S
5
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Diallyl sulfide, 98%

CAS: 592-88-1 Molecular Formula: C6H10S Molecular Weight (g/mol): 114.21 MDL Number: MFCD00008658 InChI Key: UBJVUCKUDDKUJF-UHFFFAOYSA-N Synonym: diallyl sulfide,allyl sulfide,oil garlic,diallylsulfide,thioallyl ether,1-propene, 3,3'-thiobis,allyl monosulfide,diallyl thioether,diallyl monosulfide,diallyl sulphide PubChem CID: 11617 ChEBI: CHEBI:4489 SMILES: C=CCSCC=C

PubChem CID 11617
CAS 592-88-1
Molecular Weight (g/mol) 114.21
ChEBI CHEBI:4489
MDL Number MFCD00008658
SMILES C=CCSCC=C
Synonym diallyl sulfide,allyl sulfide,oil garlic,diallylsulfide,thioallyl ether,1-propene, 3,3'-thiobis,allyl monosulfide,diallyl thioether,diallyl monosulfide,diallyl sulphide
InChI Key UBJVUCKUDDKUJF-UHFFFAOYSA-N
Molecular Formula C6H10S
6
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Diallyl disulfide, tech. 80%, remainder mainly diallyl sulfide and diallyl trisulfide

CAS: 2179-57-9 Molecular Formula: C6H10S2 Molecular Weight (g/mol): 146.27 MDL Number: MFCD00008656 InChI Key: PFRGXCVKLLPLIP-UHFFFAOYSA-N Synonym: diallyl disulfide,allyl disulfide,diallyldisulfide,diallyl disulphide,disulfide, di-2-propenyl,1,2-diallyldisulfane,2-propenyl disulphide,allyl disulphide,4,5-dithia-1,7-octadiene,3-allyldisulfanyl-propene PubChem CID: 16590 ChEBI: CHEBI:4488 IUPAC Name: 3-(prop-2-enyldisulfanyl)prop-1-ene SMILES: C=CCSSCC=C

PubChem CID 16590
CAS 2179-57-9
Molecular Weight (g/mol) 146.27
ChEBI CHEBI:4488
MDL Number MFCD00008656
SMILES C=CCSSCC=C
Synonym diallyl disulfide,allyl disulfide,diallyldisulfide,diallyl disulphide,disulfide, di-2-propenyl,1,2-diallyldisulfane,2-propenyl disulphide,allyl disulphide,4,5-dithia-1,7-octadiene,3-allyldisulfanyl-propene
IUPAC Name 3-(prop-2-enyldisulfanyl)prop-1-ene
InChI Key PFRGXCVKLLPLIP-UHFFFAOYSA-N
Molecular Formula C6H10S2
7
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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

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
8
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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

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
9
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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

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
10
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Diphenyl sulfide, 98%

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

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
11
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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

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
12
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6-(Methylthio)pyridine-3-boronic acid, 95%, Thermo Scientific™

CAS: 321438-86-2 Molecular Formula: C6H8BNO2S Molecular Weight (g/mol): 169.005 MDL Number: MFCD03788238 InChI Key: UXWKVPJOPVIIRU-UHFFFAOYSA-N Synonym: 2-methylthiopyridine-5-boronic acid,6-methylthio pyridin-3-ylboronic acid,2-methylthio-5-pyridinyl-boronic acid,2-methylthio-pyridine-5-boronic acid,6-methylthio pyridin-3-yl boronic acid,6-methylsulphanyl pyridine-3-boronic acid,6-methylthio pyridin-3-yl-3-boronic acid,6-methylthio pyridine-3-boronic acid,5-borono-2-methylmercapto pyridine,6-methylsulfanyl pyridin-3-ylboronic acid PubChem CID: 2762705 IUPAC Name: (6-methylsulfanylpyridin-3-yl)boronic acid SMILES: B(C1=CN=C(C=C1)SC)(O)O

PubChem CID 2762705
CAS 321438-86-2
Molecular Weight (g/mol) 169.005
MDL Number MFCD03788238
SMILES B(C1=CN=C(C=C1)SC)(O)O
Synonym 2-methylthiopyridine-5-boronic acid,6-methylthio pyridin-3-ylboronic acid,2-methylthio-5-pyridinyl-boronic acid,2-methylthio-pyridine-5-boronic acid,6-methylthio pyridin-3-yl boronic acid,6-methylsulphanyl pyridine-3-boronic acid,6-methylthio pyridin-3-yl-3-boronic acid,6-methylthio pyridine-3-boronic acid,5-borono-2-methylmercapto pyridine,6-methylsulfanyl pyridin-3-ylboronic acid
IUPAC Name (6-methylsulfanylpyridin-3-yl)boronic acid
InChI Key UXWKVPJOPVIIRU-UHFFFAOYSA-N
Molecular Formula C6H8BNO2S
13
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3-Aminothiobenzamide, 97%

CAS: 78950-36-4 Molecular Formula: C7H8N2S Molecular Weight (g/mol): 152.215 MDL Number: MFCD04973325 InChI Key: ZKWTUTBIHCNCKU-UHFFFAOYSA-N Synonym: 3-aminothiobenzamide,3-aminobenzothioamide,3-amino-thiobenzamide,3-aminobenzene-1-carbothioamide,3-aminobenzthioamide,3-azanylbenzenecarbothioamide,#,benzenecarbothioamide,3-amino,3-amino-benzenecarbothioamide,amino 3-aminophenyl methane-1-thione PubChem CID: 2060897 IUPAC Name: 3-aminobenzenecarbothioamide SMILES: C1=CC(=CC(=C1)N)C(=S)N

PubChem CID 2060897
CAS 78950-36-4
Molecular Weight (g/mol) 152.215
MDL Number MFCD04973325
SMILES C1=CC(=CC(=C1)N)C(=S)N
Synonym 3-aminothiobenzamide,3-aminobenzothioamide,3-amino-thiobenzamide,3-aminobenzene-1-carbothioamide,3-aminobenzthioamide,3-azanylbenzenecarbothioamide,#,benzenecarbothioamide,3-amino,3-amino-benzenecarbothioamide,amino 3-aminophenyl methane-1-thione
IUPAC Name 3-aminobenzenecarbothioamide
InChI Key ZKWTUTBIHCNCKU-UHFFFAOYSA-N
Molecular Formula C7H8N2S
14
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2-Aminothiobenzamide, 97%

CAS: 2454-39-9 Molecular Formula: C7H8N2S Molecular Weight (g/mol): 152.215 MDL Number: MFCD00963496 InChI Key: HPZKAJRFABCGFF-UHFFFAOYSA-N Synonym: 2-aminothiobenzamide,2-amino-thiobenzamide,2-aminobenzothioamide,benzenecarbothioamide, 2-amino,thioanthranilamide,o-aminothiobenzamide,2-aminobenzene-1-carbothioamide,amino 2-aminophenyl methane-1-thione,benzamide, o-aminothio,thioanthranilsaureamid PubChem CID: 1550990 IUPAC Name: 2-aminobenzenecarbothioamide SMILES: C1=CC=C(C(=C1)C(=S)N)N

PubChem CID 1550990
CAS 2454-39-9
Molecular Weight (g/mol) 152.215
MDL Number MFCD00963496
SMILES C1=CC=C(C(=C1)C(=S)N)N
Synonym 2-aminothiobenzamide,2-amino-thiobenzamide,2-aminobenzothioamide,benzenecarbothioamide, 2-amino,thioanthranilamide,o-aminothiobenzamide,2-aminobenzene-1-carbothioamide,amino 2-aminophenyl methane-1-thione,benzamide, o-aminothio,thioanthranilsaureamid
IUPAC Name 2-aminobenzenecarbothioamide
InChI Key HPZKAJRFABCGFF-UHFFFAOYSA-N
Molecular Formula C7H8N2S
15
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Benzene-1,4-dithiocarboxamide, 97%

CAS: 13363-51-4 Molecular Formula: C8H8N2S2 Molecular Weight (g/mol): 196.286 MDL Number: MFCD00046866 InChI Key: USHPIZCRGQUHGN-UHFFFAOYSA-N Synonym: benzene-1,4-dithiocarboxamide,1,4-benzenedicarbothioamide,benzene-1,4-bis carbothioamide PubChem CID: 2795175 IUPAC Name: benzene-1,4-dicarbothioamide SMILES: C1=CC(=CC=C1C(=S)N)C(=S)N

PubChem CID 2795175
CAS 13363-51-4
Molecular Weight (g/mol) 196.286
MDL Number MFCD00046866
SMILES C1=CC(=CC=C1C(=S)N)C(=S)N
Synonym benzene-1,4-dithiocarboxamide,1,4-benzenedicarbothioamide,benzene-1,4-bis carbothioamide
IUPAC Name benzene-1,4-dicarbothioamide
InChI Key USHPIZCRGQUHGN-UHFFFAOYSA-N
Molecular Formula C8H8N2S2