5-Allyl-5-Sec-Butyl-2-Sodiothio-4,6(1H,5H)-Pyrimidinedione
[CAS# 64058-14-6]

Identification

• Name: 5-Allyl-5-Sec-Butyl-2-Sodiothio-4,6(1H,5H)-Pyrimidinedione
• Synonyms: Sodium 5-Butan-2-Yl-6-Oxo-5-Prop-2-Enyl-2-Sulfanylidenepyrimidin-4-Olate; Sodium 5-Allyl-4,6-Dioxo-5-Sec-Butyl-1H-Pyrimidine-2-Thiolate; Sodium 5-Allyl-6-Oxo-5-Sec-Butyl-2-Thioxo-Pyrimidin-4-Olate
• Molecular Formula: C₁₁H₁₅N₂NaO₂S
• Molecular Weight: 262.30
• CAS Registry Number: 64058-14-6
• SMILES: C(C1(C(=O)[N-]C(=S)NC1=O)C(CC)C)C=C.[Na+]
• InChI: 1S/C11H16N2O2S.Na/c1-4-6-11(7(3)5-2)8(14)12-10(16)13-9(11)15;/h4,7H,1,5-6H2,2-3H3,(H2,12,13,14,15,16);/q;+1/p-1
• InChIKey: ODAJVSVRPUSJQQ-UHFFFAOYSA-M