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    Technical details about Carnidazole, learn more about the structure, uses, toxicity, action, side effects and more

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    Carnidazole

    APIs // Active Pharmaceutical Ingredients

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    2D Structure
    1. Also known as: 42116-76-7, Me 108, Nsc 293873, Nsc-293873, R 25831, O-methyl n-[2-(2-methyl-5-nitroimidazol-1-yl)ethyl]carbamothioate
    Molecular Formula
    C8H12N4O3S
    Molecular Weight
    244.27  g/mol
    InChI Key
    OVEVHVURWWTPFC-UHFFFAOYSA-N
    FDA UNII
    RH5KI819JG
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    O-methyl N-[2-(2-methyl-5-nitroimidazol-1-yl)ethyl]carbamothioate
    2.1.2 InChI
    InChI=1S/C8H12N4O3S/c1-6-10-5-7(12(13)14)11(6)4-3-9-8(16)15-2/h5H,3-4H2,1-2H3,(H,9,16)
    2.1.3 InChI Key
    OVEVHVURWWTPFC-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC1=NC=C(N1CCNC(=S)OC)[N+](=O)[O-]
    2.2 Other Identifiers
    2.2.1 UNII
    RH5KI819JG
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. O-methyl(2-(2-methyl-5-nitro-1h-imidazol-1-yl)ethyl)carbonothioate

    2. R 25831

    3. R-2581

    2.3.2 Depositor-Supplied Synonyms

    1. 42116-76-7

    2. Me 108

    3. Nsc 293873

    4. Nsc-293873

    5. R 25831

    6. O-methyl N-[2-(2-methyl-5-nitroimidazol-1-yl)ethyl]carbamothioate

    7. R 28,096 [as Hydrochloride]

    8. R 25,831 [as The Free Base]

    9. O-methyl (2-(2-methyl-5-nitroimidazol-1-yl)ethyl)thiocarbamate

    10. Rh5ki819jg

    11. O-methyl (2-(2-methyl-5-nitro-1h-imidazol-1-yl)ethyl)carbamothioate

    12. 1-(2-ethylcarbamothioic Acid O-methyl Ester)-2-methyl-5-nitroimidazole

    13. (2-(2-methyl-5-nitro-1h-imidazol-1-yl)ethyl)carbamothioic Acid O-methyl Ester

    14. Me-108

    15. Nsc293873

    16. Carbamothioic Acid, (2-(2-methyl-5-nitro-1h-imidazol-1-yl)ethyl)-, O-methyl Ester

    17. Carnidazole (usan)

    18. Carnidazole [usan]

    19. R-25831

    20. R 25,831

    21. Carnidazolum

    22. O-methyl [2-(2-methyl-5-nitroimidazol-1-yl)ethyl]thiocarbamate

    23. N-[2-(2-methyl-5-nitro-1h-imidazol-1-yl)ethyl]methoxycarbothioamide

    24. Carnidazol [inn-spanish]

    25. Carnidazolum [inn-latin]

    26. Carbamothioic Acid, [2-(2-methyl-5-nitro-1h-imidazol-1-yl)ethyl]-, O-methyl Ester

    27. Carnidazole [usan:inn:ban]

    28. Einecs 255-663-0

    29. Unii-rh5ki819jg

    30. Brn 0620260

    31. Spartrix

    32. Carnidazole [mi]

    33. Carnidazole [inn]

    34. Carnidazole [mart.]

    35. Schembl637201

    36. Chembl135000

    37. Carnidazole [green Book]

    38. R-28096 Free Base

    39. Dtxsid40194957

    40. Chebi:177789

    41. R 25831 (as The Free Base)

    42. R 28,096 Free Base

    43. Me108

    44. R 28096 (as The Free Base))

    45. Zinc5425133

    46. Ncgc00532504-01

    47. Hy-119900

    48. Cs-0078313

    49. D03408

    50. Carnidazole, Vetranal(tm), Analytical Standard

    51. Q5044050

    52. O-methyl 2-(2-methyl-5-nitro-1h-imidazol-1-yl)ethylthiocarbamate #

    53. O-methyl[2-(2-methyl-5-nitro-1h-imidazol-1-yl)ethyl]thiocarbamate

    54. Carbamothioic Acid, N-[2-(2-methyl-5-nitro-1h-imidazol-1-yl)ethyl]-, O-methyl Ester

    2.4 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 244.27 g/mol
    Molecular Formula C8H12N4O3S
    XLogP31.1
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count5
    Rotatable Bond Count4
    Exact Mass244.06301143 g/mol
    Monoisotopic Mass244.06301143 g/mol
    Topological Polar Surface Area117 Ų
    Heavy Atom Count16
    Formal Charge0
    Complexity271
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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