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    Technical details about Prestwick3_000011, learn more about the structure, uses, toxicity, action, side effects and more

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    Prestwick3_000011

    APIs // Active Pharmaceutical Ingredients

    PharmaCompass

    Phyton is a World Leader in Plant Cell Fermentation Technology and Commercial Manufacturing.

    Athena Pharmaceutiques is a Partner of Choice for Drug Delivery & Life Cycle Management.

    2D Structure
    1. Also known as: 1084-65-7, Arresten, Fontiliz, 6-methylthiochroman-7-sulfonamide 1,1-dioxide, Sd 17102, 6-methyl-1,1-dioxo-3,4-dihydro-2h-thiochromene-7-sulfonamide
    Molecular Formula
    C10H13NO4S2
    Molecular Weight
    275.3  g/mol
    InChI Key
    FNQQBFNIYODEMB-UHFFFAOYSA-N
    FDA UNII
    I7EKN1924Q
    Meticrane is a sulphonamide-derivative with thiazide-like diuretic activity. Meticrane acts in a similar manner as the thiazide diuretics.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    6-methyl-1,1-dioxo-3,4-dihydro-2H-thiochromene-7-sulfonamide
    2.1.2 InChI
    InChI=1S/C10H13NO4S2/c1-7-5-8-3-2-4-16(12,13)10(8)6-9(7)17(11,14)15/h5-6H,2-4H2,1H3,(H2,11,14,15)
    2.1.3 InChI Key
    FNQQBFNIYODEMB-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC1=CC2=C(C=C1S(=O)(=O)N)S(=O)(=O)CCC2
    2.2 Other Identifiers
    2.2.1 UNII
    I7EKN1924Q
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 1084-65-7

    2. Arresten

    3. Fontiliz

    4. 6-methylthiochroman-7-sulfonamide 1,1-dioxide

    5. Sd 17102

    6. 6-methyl-1,1-dioxo-3,4-dihydro-2h-thiochromene-7-sulfonamide

    7. Nsc-759309

    8. 2h-1-benzothiopyran-7-sulfonamide, 3,4-dihydro-6-methyl-, 1,1-dioxide

    9. I7ekn1924q

    10. Ncgc00016561-01

    11. Sd-17102

    12. Cas-1084-65-7

    13. Meticranum [inn-latin]

    14. 6-methylthiochromane-7-sulfonamide 1,1-dioxide

    15. Dsstox_cid_25346

    16. Dsstox_rid_80814

    17. Dsstox_gsid_45346

    18. Meticranum

    19. Meticran

    20. Meticrano

    21. Meticrano [inn-spanish]

    22. 2h-1-benzothiopyran-7-sulfonamide, 3,4-dihydro-6-methyl-, 1,1-dioxide (9ci)

    23. 6-methylthiochroman-7-sulphonamide 1,1-dioxide;6-methylthiochroman-7-sulfonamide 1,1-dioxide

    24. Meticrane [inn:dcf:jan]

    25. Sr-01000838874

    26. Einecs 214-112-4

    27. E-103-e

    28. Unii-i7ekn1924q

    29. 6-methyl-7-sulfamido-thiochroman-1,1-dioxide

    30. Arresten (tn)

    31. Prestwick_881

    32. Thiochroman-7-sulfonamide, 6-methyl-, 1,1-dioxide

    33. Meticrane [inn]

    34. Meticrane [jan]

    35. Meticrane [mi]

    36. Prestwick0_000011

    37. Prestwick1_000011

    38. Prestwick2_000011

    39. Prestwick3_000011

    40. 6-methyl-3,4-dihydro-2h-1-benzothiopyran-7-sulfonamide 1,1-dioxide

    41. Meticrane (jp17/inn)

    42. Meticrane [mart.]

    43. Meticrane [who-dd]

    44. Schembl49070

    45. Bspbio_000041

    46. Mls002154170

    47. Meticrane, Analytical Standard

    48. Spbio_001962

    49. Bpbio1_000047

    50. Zinc1718

    51. Chembl1318341

    52. Dtxsid9045346

    53. Chebi:31839

    54. Hms1568c03

    55. Hms2095c03

    56. Hms2235d06

    57. Hms3371d22

    58. Hms3712c03

    59. Pharmakon1600-01506077

    60. Baa08465

    61. Hy-b0908

    62. Tox21 110495

    63. Tox21_110495

    64. Mfcd00079454

    65. Nsc759309

    66. S4339

    67. 6-methyl-1-thia-1,2,3,4-tetrahydronaphthalene-7-sulfonamide 1,1-dioxide

    68. Akos016014038

    69. Tox21_110495_1

    70. Ccg-214046

    71. Db13284

    72. Nsc 759309

    73. Ncgc00016561-02

    74. Ncgc00016561-05

    75. Bs-14410

    76. Smr001233468

    77. Sbi-0207038.p001

    78. Ft-0725174

    79. Sw197003-3

    80. D01605

    81. E75872

    82. J-002149

    83. Q6824077

    84. Sr-01000838874-2

    85. Sr-01000838874-3

    86. Brd-k58265391-001-03-6

    87. Brd-k58265391-001-06-9

    88. 6-methyl-3,4-dihydro-2h-thiochromene-7-sulfonamide 1,1-dioxide

    89. 3,4-dihydro-6-methyl-2h-1-benzothiopyran-7-sulfonamide 1,1-dioxide

    2.4 Create Date
    2005-03-25
    3 Chemical and Physical Properties
    Molecular Weight 275.3 g/mol
    Molecular Formula C10H13NO4S2
    XLogP30.5
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count5
    Rotatable Bond Count1
    Exact Mass275.02860024 g/mol
    Monoisotopic Mass275.02860024 g/mol
    Topological Polar Surface Area111 Ų
    Heavy Atom Count17
    Formal Charge0
    Complexity485
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
    4 Pharmacology and Biochemistry
    4.1 ATC Code

    C - Cardiovascular system

    C03 - Diuretics

    C03B - Low-ceiling diuretics, excl. thiazides

    C03BA - Sulfonamides, plain

    C03BA09 - Meticrane

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