Probarbital
[CAS# 545-74-4]

Identification

• Name: Probarbital
• Synonyms: Calcium 5-Ethyl-5-Isopropyl-4,6-Dioxo-1H-Pyrimidin-2-Olate; Calcium 5-Ethyl-5-Isopropyl-4,6-Diketo-1H-Pyrimidin-2-Olate; 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-Ethyl-5-(1-Methylethyl)-, Calcium Salt (2:1) (9Ci)
• Molecular Formula: C₁₈H₂₆CaN₄O₆
• Molecular Weight: 434.51
• CAS Registry Number: 545-74-4
• SMILES: [N-]1C(=O)C(C(=O)NC1=O)(C(C)C)CC.[N-]2C(=O)C(C(=O)NC2=O)(C(C)C)CC.[Ca++]
• InChI: 1S/2C9H14N2O3.Ca/c2*1-4-9(5(2)3)6(12)10-8(14)11-7(9)13;/h2*5H,4H2,1-3H3,(H2,10,11,12,13,14);/q;;+2/p-2
• InChIKey: WZPJERQWVCHCKK-UHFFFAOYSA-L