5-Allyl-5-(1-Methylbutyl)-2-Thiobarbituric Acid, Sodium salt
[CAS# 337-47-3]

Identification

• Name: 5-Allyl-5-(1-Methylbutyl)-2-Thiobarbituric Acid, Sodium salt
• Synonyms: Sodium 6-Oxo-5-Pentan-2-Yl-5-Prop-2-Enyl-2-Sulfanylidenepyrimidin-4-Olate; Sodium 5-Allyl-5-(1-Methylbutyl)-4,6-Dioxo-1H-Pyrimidine-2-Thiolate; Sodium 5-Allyl-5-(1-Methylbutyl)-6-Oxo-2-Thioxo-Pyrimidin-4-Olate
• Molecular Formula: C₁₂H₁₇N₂NaO₂S
• Molecular Weight: 276.33
• CAS Registry Number: 337-47-3
• EINECS: 206-415-5
• SMILES: C(C1(C(=O)[N-]C(=S)NC1=O)C(CCC)C)C=C.[Na+]
• 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