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Organosulfur Compounds

Organic compounds that contain one or more sulfur atoms, or sulfur-containing functional groups.
Thioethers (368)
Isothiocyanates (157)
Sulfenyl compounds (125)
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Organic disulfides (46)
Isothioureas (32)
Thiocyanates (26)
Allyl sulfur compounds (23)
Thiohemiaminal derivatives (19)
Organic trisulfides (8)
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3-Benzyloxyphenyl isothiocyanate, 97%

CAS: 206559-36-6 Molecular Formula: C14H11NOS Molecular Weight (g/mol): 241.31 MDL Number: MFCD00060374 InChI Key: QJLFNDXMZQJMDL-UHFFFAOYSA-N Synonym: 3-benzyloxyphenyl isothiocyanate,3-benzyloxyphenylisothiocyanate,1-benzyloxy-3-isothiocyanatobenzene,acmc-20an9f,3-phenylmethoxy benzenisothiocyanate,1-benzyloxy-3-isothiocyanatobenzene #,1-isothiocyanato-3-phenylmethoxy-benzene,benzene, 1-isothiocyanato-3-phenylmethoxy,benzene, 1-isothiocyanato-3-phenylmethoxy-9ci PubChem CID: 561446 IUPAC Name: 1-isothiocyanato-3-phenylmethoxybenzene SMILES: S=C=NC1=CC(OCC2=CC=CC=C2)=CC=C1

PubChem CID 561446
CAS 206559-36-6
Molecular Weight (g/mol) 241.31
MDL Number MFCD00060374
SMILES S=C=NC1=CC(OCC2=CC=CC=C2)=CC=C1
Synonym 3-benzyloxyphenyl isothiocyanate,3-benzyloxyphenylisothiocyanate,1-benzyloxy-3-isothiocyanatobenzene,acmc-20an9f,3-phenylmethoxy benzenisothiocyanate,1-benzyloxy-3-isothiocyanatobenzene #,1-isothiocyanato-3-phenylmethoxy-benzene,benzene, 1-isothiocyanato-3-phenylmethoxy,benzene, 1-isothiocyanato-3-phenylmethoxy-9ci
IUPAC Name 1-isothiocyanato-3-phenylmethoxybenzene
InChI Key QJLFNDXMZQJMDL-UHFFFAOYSA-N
Molecular Formula C14H11NOS
2

Sulbutiamine 98.0+%, TCI America™

CAS: 3286-46-2 Molecular Formula: C32H46N8O6S2 Molecular Weight (g/mol): 702.89 MDL Number: MFCD01726427 InChI Key: CKHJPWQVLKHBIH-KKTFQPMKSA-N Synonym: Bisibuthiamine, O-Isobutyroylthiamine Disulfide PubChem CID: 24739911 IUPAC Name: [(Z)-4-[(4-amino-2-methylpyrimidin-5-yl)methyl-formylamino]-3-[[(E)-2-[(4-amino-2-methylpyrimidin-5-yl)methyl-formylamino]-5-(2-methylpropanoyloxy)pent-2-en-3-yl]disulfanyl]pent-3-enyl] 2-methylpropanoate SMILES: CC1=NC=C(C(=N1)N)CN(C=O)C(=C(CCOC(=O)C(C)C)SSC(=C(C)N(CC2=CN=C(N=C2N)C)C=O)CCOC(=O)C(C)C)C

PubChem CID 24739911
CAS 3286-46-2
Molecular Weight (g/mol) 702.89
MDL Number MFCD01726427
SMILES CC1=NC=C(C(=N1)N)CN(C=O)C(=C(CCOC(=O)C(C)C)SSC(=C(C)N(CC2=CN=C(N=C2N)C)C=O)CCOC(=O)C(C)C)C
Synonym Bisibuthiamine, O-Isobutyroylthiamine Disulfide
IUPAC Name [(Z)-4-[(4-amino-2-methylpyrimidin-5-yl)methyl-formylamino]-3-[[(E)-2-[(4-amino-2-methylpyrimidin-5-yl)methyl-formylamino]-5-(2-methylpropanoyloxy)pent-2-en-3-yl]disulfanyl]pent-3-enyl] 2-methylpropanoate
InChI Key CKHJPWQVLKHBIH-KKTFQPMKSA-N
Molecular Formula C32H46N8O6S2
3
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Allylthiourea, 98%

CAS: 109-57-9 MDL Number: MFCD00004940 InChI Key: HTKFORQRBXIQHD-UHFFFAOYSA-N Synonym: allylthiourea,n-allylthiourea,thiosinamine,1-allyl-2-thiourea,rhodalline,thiosinamin,tiosinamine,1-allylthiourea,aminosin,rhodallin PubChem CID: 1549517 ChEBI: CHEBI:74079 IUPAC Name: prop-2-enylthiourea SMILES: C=CCNC(=S)N

PubChem CID 1549517
CAS 109-57-9
ChEBI CHEBI:74079
MDL Number MFCD00004940
SMILES C=CCNC(=S)N
Synonym allylthiourea,n-allylthiourea,thiosinamine,1-allyl-2-thiourea,rhodalline,thiosinamin,tiosinamine,1-allylthiourea,aminosin,rhodallin
IUPAC Name prop-2-enylthiourea
InChI Key HTKFORQRBXIQHD-UHFFFAOYSA-N
4

n-Butyl sulfide, 99%, pure

CAS: 544-40-1 Molecular Formula: C8H18S Molecular Weight (g/mol): 146.29 MDL Number: MFCD00009468 InChI Key: HTIRHQRTDBPHNZ-UHFFFAOYSA-N Synonym: 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

PubChem CID 11002
CAS 544-40-1
Molecular Weight (g/mol) 146.29
MDL Number MFCD00009468
SMILES CCCCSCCCC
Synonym 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
InChI Key HTIRHQRTDBPHNZ-UHFFFAOYSA-N
Molecular Formula C8H18S
5
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Dimethyl trisulfide, 98+%

CAS: 3658-80-8 Molecular Formula: C2H6S3 Molecular Weight (g/mol): 126.27 MDL Number: MFCD00039808 InChI Key: YWHLKYXPLRWGSE-UHFFFAOYSA-N Synonym: dimethyl trisulfide,trisulfide, dimethyl,methyl trisulfide,2,3,4-trithiapentane,dimethyl trisulphide,dimethyltrisulfide,methyltrisulfanyl methane,dimethyltrisulfane,unii-3e691t3nl1,dmts PubChem CID: 19310 ChEBI: CHEBI:4614 IUPAC Name: (methyltrisulfanyl)methane SMILES: CSSSC

PubChem CID 19310
CAS 3658-80-8
Molecular Weight (g/mol) 126.27
ChEBI CHEBI:4614
MDL Number MFCD00039808
SMILES CSSSC
Synonym dimethyl trisulfide,trisulfide, dimethyl,methyl trisulfide,2,3,4-trithiapentane,dimethyl trisulphide,dimethyltrisulfide,methyltrisulfanyl methane,dimethyltrisulfane,unii-3e691t3nl1,dmts
IUPAC Name (methyltrisulfanyl)methane
InChI Key YWHLKYXPLRWGSE-UHFFFAOYSA-N
Molecular Formula C2H6S3
6
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2-Aminothiazole, 97%

CAS: 96-50-4 Molecular Formula: C3H4N2S Molecular Weight (g/mol): 100.14 MDL Number: MFCD00005325 InChI Key: RAIPHJJURHTUIC-UHFFFAOYSA-N Synonym: 2-aminothiazole,aminothiazole,2-thiazolamine,thiazol-2-amine,abadol,2-thiazolylamine,abadole,basedol,2-thiazylamine,4-thiazolin-2-onimine PubChem CID: 2155 ChEBI: CHEBI:40782 IUPAC Name: 1,3-thiazol-2-amine SMILES: NC1=NC=CS1

PubChem CID 2155
CAS 96-50-4
Molecular Weight (g/mol) 100.14
ChEBI CHEBI:40782
MDL Number MFCD00005325
SMILES NC1=NC=CS1
Synonym 2-aminothiazole,aminothiazole,2-thiazolamine,thiazol-2-amine,abadol,2-thiazolylamine,abadole,basedol,2-thiazylamine,4-thiazolin-2-onimine
IUPAC Name 1,3-thiazol-2-amine
InChI Key RAIPHJJURHTUIC-UHFFFAOYSA-N
Molecular Formula C3H4N2S
7

Imetit dihydrobromide, 98%

CAS: 32385-58-3 Molecular Formula: C6H12Br2N4S Molecular Weight (g/mol): 332.06 MDL Number: MFCD00153816 InChI Key: DOBOYMKCRRLTRF-UHFFFAOYSA-N Synonym: imetit dihydrobromide,imetit hydrobromide,s-2-imidazol-4-yl ethyl isothiourea,s-2-1h-imidazol-4-yl ethyl isothiourea dihydrobromide,2-1h-imidazol-4-yl ethyl carbamimidothioate dihydrobromide,s-2-imidazol-4-yl ethyl isothiourea dihydrobromide,imetit dihydrobromide hplc,s-2-imidazol-4-yl ethyl isothiourea 2hbr,s-2-imidazol-4-yl ethyl isothiourea dihydrochloride,2-2-1h-imidazol-5-yl ethyl isothiourea dihydrobromide PubChem CID: 11957573 ChEBI: CHEBI:64151 IUPAC Name: 2-(1H-imidazol-5-yl)ethyl carbamimidothioate;dihydrobromide SMILES: Br.Br.NC(=N)SCCC1=CN=CN1

PubChem CID 11957573
CAS 32385-58-3
Molecular Weight (g/mol) 332.06
ChEBI CHEBI:64151
MDL Number MFCD00153816
SMILES Br.Br.NC(=N)SCCC1=CN=CN1
Synonym imetit dihydrobromide,imetit hydrobromide,s-2-imidazol-4-yl ethyl isothiourea,s-2-1h-imidazol-4-yl ethyl isothiourea dihydrobromide,2-1h-imidazol-4-yl ethyl carbamimidothioate dihydrobromide,s-2-imidazol-4-yl ethyl isothiourea dihydrobromide,imetit dihydrobromide hplc,s-2-imidazol-4-yl ethyl isothiourea 2hbr,s-2-imidazol-4-yl ethyl isothiourea dihydrochloride,2-2-1h-imidazol-5-yl ethyl isothiourea dihydrobromide
IUPAC Name 2-(1H-imidazol-5-yl)ethyl carbamimidothioate;dihydrobromide
InChI Key DOBOYMKCRRLTRF-UHFFFAOYSA-N
Molecular Formula C6H12Br2N4S
8
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2-Aminothiazole, 97%

CAS: 96-50-4 Molecular Formula: C3H4N2S Molecular Weight (g/mol): 100.14 MDL Number: MFCD00005325 InChI Key: RAIPHJJURHTUIC-UHFFFAOYSA-N Synonym: 2-aminothiazole,aminothiazole,2-thiazolamine,thiazol-2-amine,abadol,2-thiazolylamine,abadole,basedol,2-thiazylamine,4-thiazolin-2-onimine PubChem CID: 2155 ChEBI: CHEBI:40782 IUPAC Name: 1,3-thiazol-2-amine SMILES: NC1=NC=CS1

PubChem CID 2155
CAS 96-50-4
Molecular Weight (g/mol) 100.14
ChEBI CHEBI:40782
MDL Number MFCD00005325
SMILES NC1=NC=CS1
Synonym 2-aminothiazole,aminothiazole,2-thiazolamine,thiazol-2-amine,abadol,2-thiazolylamine,abadole,basedol,2-thiazylamine,4-thiazolin-2-onimine
IUPAC Name 1,3-thiazol-2-amine
InChI Key RAIPHJJURHTUIC-UHFFFAOYSA-N
Molecular Formula C3H4N2S
9
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Dimethyl trisulfide, 98%

CAS: 3658-80-8 Molecular Formula: C2H6S3 Molecular Weight (g/mol): 126.25 MDL Number: MFCD00039808 InChI Key: YWHLKYXPLRWGSE-UHFFFAOYSA-N Synonym: dimethyl trisulfide,trisulfide, dimethyl,methyl trisulfide,2,3,4-trithiapentane,dimethyl trisulphide,dimethyltrisulfide,methyltrisulfanyl methane,dimethyltrisulfane,unii-3e691t3nl1,dmts PubChem CID: 19310 ChEBI: CHEBI:4614 IUPAC Name: (methyltrisulfanyl)methane SMILES: CSSSC

PubChem CID 19310
CAS 3658-80-8
Molecular Weight (g/mol) 126.25
ChEBI CHEBI:4614
MDL Number MFCD00039808
SMILES CSSSC
Synonym dimethyl trisulfide,trisulfide, dimethyl,methyl trisulfide,2,3,4-trithiapentane,dimethyl trisulphide,dimethyltrisulfide,methyltrisulfanyl methane,dimethyltrisulfane,unii-3e691t3nl1,dmts
IUPAC Name (methyltrisulfanyl)methane
InChI Key YWHLKYXPLRWGSE-UHFFFAOYSA-N
Molecular Formula C2H6S3
10
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Thioxanthene, 98%

CAS: 261-31-4 Molecular Formula: C13H10S Molecular Weight (g/mol): 198.28 MDL Number: MFCD00046936 InChI Key: PQJUJGAVDBINPI-UHFFFAOYSA-N Synonym: thioxanthene,10h-dibenzo b,e thiin,thiaxanthen,thioxanthen,dibenzothiapyran,9h-thioxanthen,10h-dibenzo b,e thiopyran,chembl79451 PubChem CID: 67495 ChEBI: CHEBI:51055 IUPAC Name: 9H-thioxanthene SMILES: C1C2=CC=CC=C2SC2=CC=CC=C12

PubChem CID 67495
CAS 261-31-4
Molecular Weight (g/mol) 198.28
ChEBI CHEBI:51055
MDL Number MFCD00046936
SMILES C1C2=CC=CC=C2SC2=CC=CC=C12
Synonym thioxanthene,10h-dibenzo b,e thiin,thiaxanthen,thioxanthen,dibenzothiapyran,9h-thioxanthen,10h-dibenzo b,e thiopyran,chembl79451
IUPAC Name 9H-thioxanthene
InChI Key PQJUJGAVDBINPI-UHFFFAOYSA-N
Molecular Formula C13H10S
11
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(Methylthio)acetonitrile, 99%

CAS: 35120-10-6 Molecular Formula: C3H5NS Molecular Weight (g/mol): 87.14 MDL Number: MFCD00001925 InChI Key: ZRIGDBVSVFSVLL-UHFFFAOYSA-N Synonym: methylthio acetonitrile,methylthioacetonitrile,methylthio-acetonitrile,2-methylsulfanyl acetonitrile,acetonitrile, methylthio,ch3sch2cn,acmc-1afh2,methylsulfanyl acetonitrile #,inchi=1/c3h5ns/c1-5-3-2-4/h3h2,1h PubChem CID: 99295 IUPAC Name: 2-methylsulfanylacetonitrile SMILES: CSCC#N

PubChem CID 99295
CAS 35120-10-6
Molecular Weight (g/mol) 87.14
MDL Number MFCD00001925
SMILES CSCC#N
Synonym methylthio acetonitrile,methylthioacetonitrile,methylthio-acetonitrile,2-methylsulfanyl acetonitrile,acetonitrile, methylthio,ch3sch2cn,acmc-1afh2,methylsulfanyl acetonitrile #,inchi=1/c3h5ns/c1-5-3-2-4/h3h2,1h
IUPAC Name 2-methylsulfanylacetonitrile
InChI Key ZRIGDBVSVFSVLL-UHFFFAOYSA-N
Molecular Formula C3H5NS
12
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Di-n-hexyl sulfide, 97%

CAS: 6294-31-1 Molecular Formula: C12H26S Molecular Weight (g/mol): 202.40 MDL Number: MFCD00009528 InChI Key: LHNRHYOMDUJLLM-UHFFFAOYSA-N Synonym: hexyl sulfide,hexane, 1,1'-thiobis,dihexyl sulfide,di-n-hexyl sulfide,7-thiatridecane,dihexyl sulphide,n-hexyl sulfide,di-n-hexylsulfide,hexylthiohexane,normal-hexyl sulfide PubChem CID: 80517 IUPAC Name: 1-hexylsulfanylhexane SMILES: CCCCCCSCCCCCC

PubChem CID 80517
CAS 6294-31-1
Molecular Weight (g/mol) 202.40
MDL Number MFCD00009528
SMILES CCCCCCSCCCCCC
Synonym hexyl sulfide,hexane, 1,1'-thiobis,dihexyl sulfide,di-n-hexyl sulfide,7-thiatridecane,dihexyl sulphide,n-hexyl sulfide,di-n-hexylsulfide,hexylthiohexane,normal-hexyl sulfide
IUPAC Name 1-hexylsulfanylhexane
InChI Key LHNRHYOMDUJLLM-UHFFFAOYSA-N
Molecular Formula C12H26S
13
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4-Nitrophenyl phenyl sulfide, 98%

CAS: 952-97-6 Molecular Formula: C12H9NO2S Molecular Weight (g/mol): 231.27 MDL Number: MFCD00024700 InChI Key: RJCBYBQJVXVVKB-UHFFFAOYSA-N Synonym: 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

PubChem CID 13720
CAS 952-97-6
Molecular Weight (g/mol) 231.27
MDL Number MFCD00024700
SMILES [O-][N+](=O)C1=CC=C(SC2=CC=CC=C2)C=C1
Synonym 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
IUPAC Name 1-nitro-4-phenylsulfanylbenzene
InChI Key RJCBYBQJVXVVKB-UHFFFAOYSA-N
Molecular Formula C12H9NO2S
14
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3-Methylthio-1-propylamine, 97%

CAS: 4104-45-4 Molecular Formula: C4H11NS Molecular Weight (g/mol): 105.199 MDL Number: MFCD00041898 InChI Key: KKYSBGWCYXYOHA-UHFFFAOYSA-N Synonym: 3-methylthiopropylamine,3-methylthio propylamine,1-propanamine, 3-methylthio,3-methylthiopropanamine,methylmercaptopropylamine,unii-1iap0cgd5s,3-methylmercaptopropylamine,3-methylthio-1-propanamine,3-methylsulfanyl propan-1-amine,1iap0cgd5s PubChem CID: 77743 ChEBI: CHEBI:16696 IUPAC Name: 3-methylsulfanylpropan-1-amine SMILES: CSCCCN

PubChem CID 77743
CAS 4104-45-4
Molecular Weight (g/mol) 105.199
ChEBI CHEBI:16696
MDL Number MFCD00041898
SMILES CSCCCN
Synonym 3-methylthiopropylamine,3-methylthio propylamine,1-propanamine, 3-methylthio,3-methylthiopropanamine,methylmercaptopropylamine,unii-1iap0cgd5s,3-methylmercaptopropylamine,3-methylthio-1-propanamine,3-methylsulfanyl propan-1-amine,1iap0cgd5s
IUPAC Name 3-methylsulfanylpropan-1-amine
InChI Key KKYSBGWCYXYOHA-UHFFFAOYSA-N
Molecular Formula C4H11NS
15
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(Benzylthio)acetone, 98%, Thermo Scientific Chemicals

CAS: 10230-69-0 Molecular Formula: C10H12OS Molecular Weight (g/mol): 180.265 MDL Number: MFCD00026241 InChI Key: OIEDQMIEPJIRFT-UHFFFAOYSA-N Synonym: 1-benzylthio acetone,1-benzylthio-2-propanone,benzylthio acetone,.alpha.-benzylthio acetone,1-benzylsulfanyl propan-2-one,1-phenylmethylthio acetone,1-benzylsulfanyl acetone,benzylthio-2-propanone,acmc-20ap9q,alpha-benzylthio acetone PubChem CID: 82472 IUPAC Name: 1-benzylsulfanylpropan-2-one SMILES: CC(=O)CSCC1=CC=CC=C1

PubChem CID 82472
CAS 10230-69-0
Molecular Weight (g/mol) 180.265
MDL Number MFCD00026241
SMILES CC(=O)CSCC1=CC=CC=C1
Synonym 1-benzylthio acetone,1-benzylthio-2-propanone,benzylthio acetone,.alpha.-benzylthio acetone,1-benzylsulfanyl propan-2-one,1-phenylmethylthio acetone,1-benzylsulfanyl acetone,benzylthio-2-propanone,acmc-20ap9q,alpha-benzylthio acetone
IUPAC Name 1-benzylsulfanylpropan-2-one
InChI Key OIEDQMIEPJIRFT-UHFFFAOYSA-N
Molecular Formula C10H12OS