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Thiamylal Sodium

Thiamylal Sodium

API0232064

Thiamylal Sodium

Thiamine and Thiamine Hydrochloride are Vitamin B1 supplements.

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  • CAS No.

    337-47-3

  • Synonyms

    Thiamylal sodium; Sodium thiamylal; UNII-T4L2P3KH7K

  • CHEMBL ID

    CHEMBL1201065

  • Indications

  • Molecule Type

    Small molecule

  • Compound CID

    23677058

  • Molecular Weight (g/mol)

    276.33

  • Molecular Formula

    C12H17N2NaO2S

  • InChI

    InChI=1S/C12H18N2O2S.Na/c1-4-6-8(3)12(7-5-2)9(15)13-11(17)14-10(12)16;/h5,8H,2,4,6-7H2,1,3H3,(H2,13,14,15,16,17);/q;+1/p-1

  • InChIKey

    LYZGJWXNOGIVQA-UHFFFAOYSA-M

  • SMILES

    CCCC(C)C1(C(=O)NC(=NC1=O)[S-])CC=C.[Na+]

  • IUPAC Name

    sodium;4,6-dioxo-5-pentan-2-yl-5-prop-2-enyl-1H-pyrimidine-2-thiolate

  • Exact Mass (Da)

    276.09084324

  • Monoisotopic Mass (Da)

    276.09084324

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