Aryl thioethers

Description:

Organosulfur compounds containing a thioether group that is substituted by an aryl group.

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  1. 2-(Phenylthio)benzoic acid
    CAS: 1527-12-4 EC Number: 216-200-8 Formula: C13H10O2S Molecular Weight: 230.28
    Solid ≥97%
    Out of Stock Item #: P1073497
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    Technical Identifiers
    IUPAC Name
    2-phenylsulfanylbenzoic acid
    SMILES
    C1=CC=C(C=C1)SC2=CC=CC=C2C(=O)O
    InChIKey
    PMLBXJKQYSENQH-UHFFFAOYSA-N
    InChI
    1S/C13H10O2S/c14-13(15)11-8-4-5-9-12(11)16-10-6-2-1-3-7-10/h1-9H,(H,14,15)
    Synonyms
    2-(Phenylthio)benzoicacid
  2. Phenyl-2-aminoethyl sulfide
    CAS: 2014-75-7 PubChem CID: 37013 Formula: C8H11NS Molecular Weight: 153.25
    Out of Stock Item #: P1073462
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    IUPAC Name
    2-phenylsulfanylethanamine
    SMILES
    C1=CC=C(C=C1)SCCN
    InChIKey
    UBKQRASXZMLQRJ-UHFFFAOYSA-N
    InChI
    1S/C8H11NS/c9-6-7-10-8-4-2-1-3-5-8/h1-5H,6-7,9H2
  3. 6-[(Phenylsulfanyl)methyl]-2-sulfanyl-4-pyrimidinol
    CAS: 189057-68-9 PubChem CID: 1488634 Formula: C11H10N2OS2 Molecular Weight: 250.34
    Out of Stock Item #: P994361
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    IUPAC Name
    6-(phenylsulfanylmethyl)-2-sulfanylidene-1H-pyrimidin-4-one
    SMILES
    C1=CC=C(C=C1)SCC2=CC(=O)NC(=S)N2
    InChIKey
    VNTBGGWDZYETPH-UHFFFAOYSA-N
    InChI
    1S/C11H10N2OS2/c14-10-6-8(12-11(15)13-10)7-16-9-4-2-1-3-5-9/h1-6H,7H2,(H2,12,13,14,15)
  4. Alamifovir
    CAS: 193681-12-8 Formula: C19H20F6N5O5PS Molecular Weight: 575.400
    Out of Stock Item #: A1050008
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    IUPAC Name
    9-[2-[bis(2,2,2-trifluoroethoxy)phosphorylmethoxy]ethyl]-6-(4-methoxyphenyl)sulfanylpurin-2-amine
    SMILES
    COC1=CC=C(C=C1)SC2=NC(=NC3=C2N=CN3CCOCP(=O)(OCC(F)(F)F)OCC(F)(F)F)N
    InChIKey
    VDBGPMJFHCJMOL-UHFFFAOYSA-N
    InChI
    1S/C19H20F6N5O5PS/c1-32-12-2-4-13(5-3-12)37-16-14-15(28-17(26)29-16)30(10-27-14)6-7-33-11-36(31,34-8-18(20,21)22)35-9-19(23,24)25/h2-5,10H,6-9,11H2,1Hshow more
  5. 4-Cyclohexyl-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-6-oxo-1H-pyrimidine-5-carbonitrile
    CAS: 301177-36-6 Formula: C18H15F3N4O3S Molecular Weight: 424.400
    Out of Stock Item #: C946971
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    IUPAC Name
    4-cyclohexyl-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-6-oxo-1H-pyrimidine-5-carbonitrile
    SMILES
    C1CCC(CC1)C2=C(C(=O)NC(=N2)SC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-])C#N
    InChIKey
    BVWCKDMNROTYMZ-UHFFFAOYSA-N
    InChI
    1S/C18H15F3N4O3S/c19-18(20,21)11-6-7-14(13(8-11)25(27)28)29-17-23-15(10-4-2-1-3-5-10)12(9-22)16(26)24-17/h6-8,10H,1-5H2,(H,23,24,26)
  6. 5-Nitro-2-[[5-(phenoxymethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]pyridine
    CAS: 345989-24-4 PubChem CID: 1327659 Formula: C20H15N5O3S Molecular Weight: 405.43
    Out of Stock Item #: N1322612
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    IUPAC Name
    5-nitro-2-[[5-(phenoxymethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]pyridine
    SMILES
    C1=CC=C(C=C1)N2C(=NN=C2SC3=NC=C(C=C3)[N+](=O)[O-])COC4=CC=CC=C4
    InChIKey
    OZUBDKIROJPQGE-UHFFFAOYSA-N
    InChI
    1S/C20H15N5O3S/c26-25(27)16-11-12-19(21-13-16)29-20-23-22-18(14-28-17-9-5-2-6-10-17)24(20)15-7-3-1-4-8-15/h1-13H,14H2
  7. 5-(3-Methylsulfonylphenyl)-4-[(1-methyl-5-tetrazolyl)thio]thieno[2,3-d]pyrimidine
    CAS: 1222765-97-0 PubChem CID: 44142148
    Out of Stock Item #: M979769
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    Technical Identifiers
    IUPAC Name
    5-(3-methylsulfonylphenyl)-4-(1-methyltetrazol-5-yl)sulfanylthieno[2,3-d]pyrimidine
    SMILES
    CN1C(=NN=N1)SC2=NC=NC3=C2C(=CS3)C4=CC(=CC=C4)S(=O)(=O)C
    InChIKey
    IIEFAIOSYLQBJX-UHFFFAOYSA-N
    InChI
    1S/C15H12N6O2S3/c1-21-15(18-19-20-21)25-14-12-11(7-24-13(12)16-8-17-14)9-4-3-5-10(6-9)26(2,22)23/h3-8H,1-2H3
  8. 4-(Methylthio)pyridine
    CAS: 22581-72-2 EC Number: 974-588-0 Formula: C6H7NS Molecular Weight: 125.19
    Solid ≥95%
    Out of Stock Item #: P769593
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    Technical Identifiers
    SMILES
    CSC1=CC=NC=C1
    InChIKey
    XCHSSZMKKXPBAI-UHFFFAOYSA-N
    InChI
    1S/C6H7NS/c1-8-6-2-4-7-5-3-6/h2-5H,1H3
    Synonyms
    4-(Methylsulfanyl)pyridine | Pyridine, 4-(methylthio)- (6CI,8CI,9CI)
  9. Phenol, 4-(propylthio)-
    CAS: 18979-80-1 Formula: C9H12OS Molecular Weight: 168.256
    Out of Stock Item #: P769477
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    Technical Identifiers
    SMILES
    CCCSC1=CC=C(C=C1)O
    InChIKey
    SPWHEQZSUUTOHK-UHFFFAOYSA-N
    InChI
    1S/C9H12OS/c1-2-7-11-9-5-3-8(10)4-6-9/h3-6,10H,2,7H2,1H3
  10. 2-(2-((4-chlorophenyl)thio)phenyl)acetic acid
    CAS: 13459-62-6 PubChem CID: 826699
    Out of Stock Item #: T768523
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    Technical Identifiers
    IUPAC Name
    2-[2-(4-chlorophenyl)sulfanylphenyl]acetic acid
    SMILES
    C1=CC=C(C(=C1)CC(=O)O)SC2=CC=C(C=C2)Cl
    InChIKey
    WZICWIASCZNZHO-UHFFFAOYSA-N
    InChI
    1S/C14H11ClO2S/c15-11-5-7-12(8-6-11)18-13-4-2-1-3-10(13)9-14(16)17/h1-8H,9H2,(H,16,17)
  11. fenbendazoleamine
    CAS: 53065-28-4 Formula: C13H11N3S Molecular Weight: 241.3115
    Out of Stock Item #: F769508
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    Technical Identifiers
    SMILES
    C1=CC=C(C=C1)SC2=CC3=C(C=C2)N=C(N3)N
    InChIKey
    OJDMYVLGXHUDMW-UHFFFAOYSA-N
    InChI
    1S/C13H11N3S/c14-13-15-11-7-6-10(8-12(11)16-13)17-9-4-2-1-3-5-9/h1-8H,(H3,14,15,16)
  12. Benzene, pentafluoro(methylthio)-
    CAS: 653-39-4 Formula: C7H3F5S Molecular Weight: 214.1557
    Out of Stock Item #: B769390
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    Technical Identifiers
    SMILES
    CSC1=C(C(=C(C(=C1F)F)F)F)F
    InChIKey
    NBOZXHXBHUVRNG-UHFFFAOYSA-N
    InChI
    1S/C7H3F5S/c1-13-7-5(11)3(9)2(8)4(10)6(7)12/h1H3
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