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    CAS 119018-29-0

    BUILDING BLOCK

    MARKET PLACE

    PharmaCompass
    Xls

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    2D Structure
    Also known as: 119018-29-0, Glimepiride sulfonamide, Glimepiride related compound b, Glimepiride sulphonamide, 4-ethyl-3-methyl-5-oxo-n-[2-(4-sulfamoylphenyl)ethyl]-2h-pyrrole-1-carboxamide, 612913u5l6
    Molecular Formula
    C16H21N3O4S
    Molecular Weight
    351.4  g/mol
    InChI Key
    AJEMFZRCUKJSES-UHFFFAOYSA-N
    FDA UNII
    612913U5L6
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    4-ethyl-3-methyl-5-oxo-N-[2-(4-sulfamoylphenyl)ethyl]-2H-pyrrole-1-carboxamide
    2.1.2 InChI
    InChI=1S/C16H21N3O4S/c1-3-14-11(2)10-19(15(14)20)16(21)18-9-8-12-4-6-13(7-5-12)24(17,22)23/h4-7H,3,8-10H2,1-2H3,(H,18,21)(H2,17,22,23)
    2.1.3 InChI Key
    AJEMFZRCUKJSES-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CCC1=C(CN(C1=O)C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N)C
    2.2 Other Identifiers
    2.2.1 UNII
    612913U5L6
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 119018-29-0

    2. Glimepiride Sulfonamide

    3. Glimepiride Related Compound B

    4. Glimepiride Sulphonamide

    5. 4-ethyl-3-methyl-5-oxo-n-[2-(4-sulfamoylphenyl)ethyl]-2h-pyrrole-1-carboxamide

    6. 612913u5l6

    7. 3-ethyl-4-methyl-2-oxo-n-[2-(4-sulfamoylphenyl)ethyl]-2,5-dihydro-1h-pyrrole-1-carboxamide

    8. 4-(2-((3-ethyl-4-methyl-2-oxo-3-pyrrolin-1-yl)carboxamido)ethyl)benzenesulfonamide

    9. 3-ethyl-4-methyl-2-oxo-n-[2-(4-sulphamoylphenyl)ethyl]-2,3-dihydro-1h-pyrrole-1-carboxamide (glimepiride Sulphonamide)

    10. Unii-612913u5l6

    11. Ec 411-850-0

    12. Oprea1_386350

    13. Schembl14371709

    14. Dtxsid20152297

    15. Amy33442

    16. Bcp10472

    17. Usp Glimepiride Related Compound B

    18. Mfcd02955393

    19. Stk993693

    20. Zinc21298457

    21. Akos005657772

    22. Ac-1493

    23. Cs-w022064

    24. Gs-3185

    25. 3-ethyl-4-methyl-2-oxo-n-(4-sulfamoylphenethyl)-2,5-dihydro-1h-pyrrole-1-carboxamide

    26. 4-(2-((3-ethyl-4-methyl-2-oxo-pyrrolin-1-yl)carboxamido)ethyl)benzenesulfonamide)

    27. 3-ethyl-4-methyl-2-oxo-2,5-dihydro-pyrrole-1-carboxylic Acid [2-(4-sulfamoyl-phenyl)-ethyl]-amide

    28. N-[2-[4-(aminosulfonyl)phenyl]ethyl]-3-ethyl-2,5-dihydro-4-methyl-2-oxo-1h-pyrrole-1-carboxamide

    29. Ft-0642911

    30. Glimepiride Impurity B [ep Impurity]

    31. C71616

    32. Glimepiride Related Compound B [usp-rs]

    33. 018e290

    34. A804150

    35. J-004054

    36. Glimepiride Related Compound B [usp Impurity]

    37. Q27263274

    38. 4-[2-(2-oxo-3-ethyl-4-methyl-3-pyrroline-1-ylcarbonylamino)ethyl]benzenesulfonamide

    39. 4-[2-(3-ethyl-4-methyl-2-oxo-3-pyrrolidine-1- Carboxamido)ethyl]benzenesulfonamide

    40. 4-[2-[(3-ethyl-4-methyl-2-oxo-3-pyrrolin-1-yl)carboxamido]ethyl] Benzenesulfonamide

    41. 1h-pyrrole-1-carboxamide, N-(2-(4-(aminosulfonyl)phenyl)ethyl)-3-ethyl-2,5-dihydro-4-methyl-2-oxo

    42. 1h-pyrrole-1-carboxamide, N-[2-[4-(aminosulfonyl)phenyl]ethyl]-3-ethyl-2,5-dihydro-4-methyl-2-oxo-

    2.4 Create Date
    2006-10-26
    3 Chemical and Physical Properties
    Molecular Weight 351.4 g/mol
    Molecular Formula C16H21N3O4S
    XLogP31.2
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count5
    Rotatable Bond Count5
    Exact Mass351.12527733 g/mol
    Monoisotopic Mass351.12527733 g/mol
    Topological Polar Surface Area118 Ų
    Heavy Atom Count24
    Formal Charge0
    Complexity628
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1