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    Chemistry

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    Also known as: Iridus, Ls 121, Diethyl-[2-[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoyl]oxyethyl]azanium;2-hydroxy-2-oxoacetate, 5adb8d9388, Naphtidrofuryl oxalate, Einecs 221-703-0
    Molecular Formula
    C26H35NO7
    Molecular Weight
    473.6  g/mol
    InChI Key
    SSAJNPNVUYMUCI-UHFFFAOYSA-N
    Gevatran
    A drug used in the management of peripheral and cerebral vascular disorders. It is claimed to enhance cellular oxidative capacity and to be a spasmolytic. (From Martindale, The Extra Pharmacopoeia, 30th ed, p1310) It may also be an antagonist at 5HT-2 serotonin receptors.
    1 2D Structure

    Gevatran

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    diethyl-[2-[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoyl]oxyethyl]azanium;2-hydroxy-2-oxoacetate
    2.1.2 InChI
    InChI=1S/C24H33NO3.C2H2O4/c1-3-25(4-2)14-16-28-24(26)21(18-22-12-8-15-27-22)17-20-11-7-10-19-9-5-6-13-23(19)20;3-1(4)2(5)6/h5-7,9-11,13,21-22H,3-4,8,12,14-18H2,1-2H3;(H,3,4)(H,5,6)
    2.1.3 InChI Key
    SSAJNPNVUYMUCI-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC[NH+](CC)CCOC(=O)C(CC1CCCO1)CC2=CC=CC3=CC=CC=C32.C(=O)(C(=O)[O-])O
    2.2 Synonyms
    2.2.1 MeSH Synonyms

    1. Artocoron

    2. Azunaftil

    3. Di Actane

    4. Di-actane

    5. Dusodril

    6. Gvatran

    7. Ls 121

    8. Ls-121

    9. Ls121

    10. Nafronyl

    11. Nafronyl Oxalate

    12. Nafronyloxalate

    13. Nafti Puren

    14. Nafti Ratiopharm

    15. Nafti Von Ct

    16. Nafti-puren

    17. Nafti-ratiopharm

    18. Naftidrofuryl

    19. Naftifurin Oxalate

    20. Naftilong

    21. Naftilux

    22. Naftiratiopharm

    23. Oxalate, Nafronyl

    24. Oxalate, Naftifurin

    25. Praxilne

    2.2.2 Depositor-Supplied Synonyms

    1. Iridus

    2. Ls 121

    3. Diethyl-[2-[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoyl]oxyethyl]azanium;2-hydroxy-2-oxoacetate

    4. 5adb8d9388

    5. Naphtidrofuryl Oxalate

    6. Einecs 221-703-0

    7. Nsc 225233

    8. Unii-5adb8d9388

    9. 2-(diethylamino)ethyl Tetrahydro-alpha-(1-naphthylmethyl)-2-furanpropionate Oxalate (1:1)

    10. 2-furanpropanoic Acid, Tetrahydro-alpha-(1-naphthalenylmethyl)-, 2-(diethylamino)ethyl Ester, Ethanedioate (1:1)

    11. 2-furanpropionic Acid, Tetrahydro-alpha-(1-naphthylmethyl)-, 2-(diethylamino)ethyl Ester, Oxalate (1:1)

    12. Diethyl(2-(2-(1-naphthylmethyl)-3-(tetrahydro-2-furyl)propionyloxy)ethyl)ammonium Hydrogen Oxalate

    2.3 Create Date
    2005-08-08
    3 Chemical and Physical Properties
    Molecular Weight 473.6 g/mol
    Molecular Formula C26H35NO7
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count7
    Rotatable Bond Count11
    Exact Mass473.24135246 g/mol
    Monoisotopic Mass473.24135246 g/mol
    Topological Polar Surface Area117 Ų
    Heavy Atom Count34
    Formal Charge0
    Complexity543
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count2
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2
    4 Pharmacology and Biochemistry
    4.1 MeSH Pharmacological Classification

    Serotonin Antagonists

    Drugs that bind to but do not activate serotonin receptors, thereby blocking the actions of serotonin or SEROTONIN RECEPTOR AGONISTS. (See all compounds classified as Serotonin Antagonists.)

    Vasodilator Agents

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

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