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    CAS 1071-37-0

    BUILDING BLOCK

    PharmaCompass
    Xls

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    2D Structure
    Also known as: 1071-37-0, 2-ethyl-2-thiopseudourea hydrobromide, Eit hydrobromide, Ethiron, Ethiron bromide, Ethyl carbamimidothioate hydrobromide
    Molecular Formula
    C3H9BrN2S
    Molecular Weight
    185.09  g/mol
    InChI Key
    SWXXKWPYNMZFTE-UHFFFAOYSA-N
    FDA UNII
    T9389OA11M
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    ethyl carbamimidothioate;hydrobromide
    2.1.2 InChI
    InChI=1S/C3H8N2S.BrH/c1-2-6-3(4)5;/h2H2,1H3,(H3,4,5);1H
    2.1.3 InChI Key
    SWXXKWPYNMZFTE-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CCSC(=N)N.Br
    2.2 Other Identifiers
    2.2.1 UNII
    T9389OA11M
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 2-ethylisothiourea Hydrobromide

    2. Ethylisothiuronium Bromide

    3. Ethyron

    4. Etiron

    5. Etiron Monohydrobromide

    6. S-ethylisothiourea

    2.3.2 Depositor-Supplied Synonyms

    1. 1071-37-0

    2. 2-ethyl-2-thiopseudourea Hydrobromide

    3. Eit Hydrobromide

    4. Ethiron

    5. Ethiron Bromide

    6. Ethyl Carbamimidothioate Hydrobromide

    7. (ethylsulfanyl)methanimidamide Hydrobromide

    8. S-ethylisothiouronium Hydrobromide

    9. S-ethylisothiuronium Bromide

    10. 2-ethylisothiourea Hydrobromide

    11. S-ethylthiuronium Bromide

    12. Bromide S-ethylisothiuronium

    13. Usaf El-18

    14. 2-ethylisothiourea Hydrobomide

    15. Wr 539

    16. Carbamimidothioic Acid, Ethyl Ester, Monohydrobromide

    17. Ethyl Carbamimidothioate;hydrobromide

    18. S-ethylisothiourea Hbr

    19. S-ethylisothio Urea, Hydrobromide

    20. Pseudourea, 2-ethyl-2-thio-, Hydrobromide

    21. T9389oa11m

    22. Nsc-27208

    23. Isothuron Hydrobromide

    24. Isothurone Hydrobromide

    25. 2-ethylisothiourea

    26. Sr-01000075856

    27. Nsc 27208

    28. S-ethylthiourea Hydrobromide

    29. 2-ethyl-2-thiopseudourea, Hydrobromide

    30. Pseudourea, 2-ethyl-2-thio-, Monohydrobromide

    31. Mfcd00012585

    32. Wln: Shyzun2

    33. S-ethylthioureahydrobromide

    34. Schembl18169

    35. Ethyl Isothiourea Hydrobromide

    36. Mls002153234

    37. Spectrum1505161

    38. Unii-t9389oa11m

    39. S-ethylisothiourea-hydrobromide

    40. Chembl1255945

    41. (s)-ethylisothiourea Hydrobromide

    42. Bcp20133

    43. Nsc27208

    44. Tox21_500491

    45. Wr-539

    46. Akos016353460

    47. Ccg-221795

    48. Lp00491

    49. Ncgc00093894-01

    50. Ncgc00093894-02

    51. Ncgc00261176-01

    52. As-63217

    53. Smr001230700

    54. Db-040735

    55. 2-ethyl-2-thiopseudourea Hydrobromide, 98%

    56. B6481

    57. Cs-0021039

    58. E0182

    59. Eu-0100491

    60. Ft-0633285

    61. En300-70503

    62. [amino(ethylsulfanyl)methylidene]azanium;bromide

    63. D86401

    64. E 3149

    65. J-001710

    66. Sr-01000075856-1

    67. Sr-01000075856-3

    68. Sr-01000075856-7

    69. Carbamimidothioic Acid, Ethyl Ester, Hydrobromide (1:1)

    2.4 Create Date
    2005-08-01
    3 Chemical and Physical Properties
    Molecular Weight 185.09 g/mol
    Molecular Formula C3H9BrN2S
    Hydrogen Bond Donor Count3
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count2
    Exact Mass183.96698 g/mol
    Monoisotopic Mass183.96698 g/mol
    Topological Polar Surface Area75.2 Ų
    Heavy Atom Count7
    Formal Charge0
    Complexity52.8
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2
    4 Pharmacology and Biochemistry
    4.1 MeSH Pharmacological Classification

    Enzyme Inhibitors

    Compounds or agents that combine with an enzyme in such a manner as to prevent the normal substrate-enzyme combination and the catalytic reaction. (See all compounds classified as Enzyme Inhibitors.)

    Hypnotics and Sedatives

    Drugs used to induce drowsiness or sleep or to reduce psychological excitement or anxiety. (See all compounds classified as Hypnotics and Sedatives.)

    Vasoconstrictor Agents

    Drugs used to cause constriction of the blood vessels. (See all compounds classified as Vasoconstrictor Agents.)