4-[[4-[[(2,6-Dimethoxy-4-Pyrimidinyl)Amino]Sulphonyl]Phenyl]Amino]-4-Oxoisocrotonic Acid
[CAS# 30047-37-1]

Identification

• Name: 4-[[4-[[(2,6-Dimethoxy-4-Pyrimidinyl)Amino]Sulphonyl]Phenyl]Amino]-4-Oxoisocrotonic Acid
• Synonyms: (E)-4-[[4-[(2,6-Dimethoxypyrimidin-4-Yl)Sulfamoyl]Phenyl]Amino]-4-Oxobut-2-Enoic Acid; 4-[[4-[(2,6-Dimethoxypyrimidin-4-Yl)Sulfamoyl]Phenyl]Amino]-4-Oxo-But-2-Enoic Acid; (E)-4-[[4-[(2,6-Dimethoxypyrimidin-4-Yl)Sulfamoyl]Phenyl]Amino]-4-Oxo-But-2-Enoic Acid
• Molecular Formula: C₁₆H₁₆N₄O₇S
• Molecular Weight: 408.39
• CAS Registry Number: 30047-37-1
• EINECS: 250-015-3
• SMILES: C1=C(N=C(N=C1OC)OC)N[S](C2=CC=C(NC(/C=C/C(=O)O)=O)C=C2)(=O)=O
• InChI: 1S/C16H16N4O7S/c1-26-14-9-12(18-16(19-14)27-2)20-28(24,25)11-5-3-10(4-6-11)17-13(21)7-8-15(22)23/h3-9H,1-2H3,(H,17,21)(H,22,23)(H,18,19,20)/b8-7+
• InChIKey: XSJBDLAZVFZVTD-BQYQJAHWSA-N

Properties

• Density: 1.528g/cm³ (Cal.)