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    Unithiol

    ACTIVE PHARMA INGREDIENTS

    DIGITAL CONTENT

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    2D Structure
    Also known as: 4076-02-2, Sodium 2,3-dimercapto-1-propanesulfonate, Sodium 2,3-dimercaptopropane-1-sulfonate, Dmps, Unitiol, Dimaval
    Molecular Formula
    C3H7NaO3S3
    Molecular Weight
    210.3  g/mol
    InChI Key
    FGGPAWQCCGEWTJ-UHFFFAOYSA-M
    FDA UNII
    690VN2L7TK
    A chelating agent used as an antidote to heavy metal poisoning.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    sodium;2,3-bis(sulfanyl)propane-1-sulfonate
    2.1.2 InChI
    InChI=1S/C3H8O3S3.Na/c4-9(5,6)2-3(8)1-7;/h3,7-8H,1-2H2,(H,4,5,6);/q;+1/p-1
    2.1.3 InChI Key
    FGGPAWQCCGEWTJ-UHFFFAOYSA-M
    2.1.4 Canonical SMILES
    C(C(CS(=O)(=O)[O-])S)S.[Na+]
    2.2 Other Identifiers
    2.2.1 UNII
    690VN2L7TK
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 1-sodium Sulfonate, 2,3-dimercaptopropane

    2. 2,3 Dimercapto 1 Propanesulfonic Acid

    3. 2,3 Dimercaptopropane 1 Sodium Sulfonate

    4. 2,3 Dimercaptopropane 1 Sulfonate Sodium

    5. 2,3 Dimercaptopropanesulfonic Acid

    6. 2,3-dimercapto-1-propanesulfonic Acid

    7. 2,3-dimercaptopropane 1-sodium Sulfonate

    8. 2,3-dimercaptopropane Sulfonate, Sodium

    9. 2,3-dimercaptopropane-1-sulfonate Sodium

    10. 2,3-dimercaptopropanesulfonic Acid

    11. 2,3-dithiopropanesulfate, Sodium

    12. Dimaval

    13. Dmps

    14. Dmps Heyl

    15. Dmps-heyl

    16. Mercuval

    17. Sodium 2,3-dimercaptopropane Sulfonate

    18. Sodium 2,3-dithiopropanesulfate

    19. Unitiol

    2.3.2 Depositor-Supplied Synonyms

    1. 4076-02-2

    2. Sodium 2,3-dimercapto-1-propanesulfonate

    3. Sodium 2,3-dimercaptopropane-1-sulfonate

    4. Dmps

    5. Unitiol

    6. Dimaval

    7. Sodium 2,3-dimercaptopropanesulfonate

    8. 1-propanesulfonic Acid, 2,3-dimercapto-, Monosodium Salt

    9. Sodium 2,3-dimercaptopropanesulphonate

    10. 2,3-dimercapto-1-propanesulfonic Acid Sodium Salt

    11. 690vn2l7tk

    12. Sodium;2,3-bis(sulfanyl)propane-1-sulfonate

    13. Sodium 2,3-disulfanylpropane-1-sulfonate

    14. 2,3-dimercaptopropane-1-sulfonate Sodium

    15. Sodium 2,3-dithiolpropanesulfonate

    16. Einecs 223-796-3

    17. 2,3-dimercaptopropane Sodium Sulphonate

    18. (+)-dmps

    19. (-)-dmps

    20. Sodium 2,3-bis(sulfanyl)propane-1-sulfonate

    21. Unithiol [mart.]

    22. Unithiol [who-dd]

    23. 2,3-dimercaptopropanesulfonic Acid Sodium Salt

    24. Dmps (sodium Salt)

    25. Unii-690vn2l7tk

    26. Schembl164318

    27. Niosh/tz6420050

    28. Niosh/tz6420100

    29. Sodium Dimercaptopropane Sulfonate

    30. Dtxsid40958410

    31. Amy22488

    32. Mfcd00007523

    33. Stl372655

    34. Akos015898653

    35. Akos015967317

    36. Sodium 2,3-dimercapto-sulfonate

    37. Sodium Dimercaptopropanesulphonate

    38. As-64437

    39. Sodium Dimercaptopropane Sulphonate

    40. Db-049647

    41. Ft-0609675

    42. Tz64200500

    43. Tz64201000

    44. H10946

    45. 2,3-dimercaptopropane-1-sulphonate Sodium

    46. A923350

    47. Dimercaptopropane Sulfonic Acid Sodium Salt

    48. Sodium 2,3-dimercapto-1-propanesulphonate

    49. (+)-2,3-dimercapto-1-propanesulfonate Sodium Salt

    50. (-)-2,3-dimercapto-1-propanesulfonate Sodium Salt

    51. D-2,3-dimercapto-1-propanesulfonic Acid Sodium Salt

    52. L-2,3-dimercapto-1-propanesulfonic Acid Sodium Salt

    53. Q-201912

    54. Q26841293

    55. 1-propanesulfonic Acid, 2,3-dimercapto-, Sodium Salt, (+)-

    56. 1-propanesulfonic Acid, 2,3-dimercapto-, Sodium Salt, (-)-

    57. 2,3-dimercapto-1-propanesulfonic Acid Sodium Salt [mi]

    58. 1-propanesulfonic Acid, 2,3-dimercapto-, Sodium Salt (1:1)

    59. 37260-06-3

    2.4 Create Date
    2005-07-19
    3 Chemical and Physical Properties
    Molecular Weight 210.3 g/mol
    Molecular Formula C3H7NaO3S3
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count5
    Rotatable Bond Count3
    Exact Mass209.94550188 g/mol
    Monoisotopic Mass209.94550188 g/mol
    Topological Polar Surface Area67.6 Ų
    Heavy Atom Count10
    Formal Charge0
    Complexity160
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count1
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2
    4 Pharmacology and Biochemistry
    4.1 MeSH Pharmacological Classification

    Antidotes

    Agents counteracting or neutralizing the action of POISONS. (See all compounds classified as Antidotes.)

    Chelating Agents

    Chemicals that bind to and remove ions from solutions. Many chelating agents function through the formation of COORDINATION COMPLEXES with METALS. (See all compounds classified as Chelating Agents.)