3-Chloro-5-[(4,6-Dimethoxypyrimidin-2-Yl)Carbamoylsulfamoyl]-1-Methylpyrazole-4-Carboxylic Acid
[CAS# 135397-30-7]

Identification

• Name: 3-Chloro-5-[(4,6-Dimethoxypyrimidin-2-Yl)Carbamoylsulfamoyl]-1-Methylpyrazole-4-Carboxylic Acid
• Synonyms: 3-Chloro-5-[(4,6-Dimethoxypyrimidin-2-Yl)Carbamoylsulfamoyl]-1-Methyl-Pyrazole-4-Carboxylic Acid; 3-Chloro-5-[[[(4,6-Dimethoxy-2-Pyrimidinyl)Amino]-Oxomethyl]Sulfamoyl]-1-Methyl-4-Pyrazolecarboxylic Acid; 1H-Pyrazole-4-Carboxylic Acid, 3-Chloro-5-(((((4,6-Dimethoxy-2-Pyrimidinyl)Amino)Carbonyl)Amino)Sulfonyl)-1-Methyl-
• Molecular Formula: C₁₂H₁₃ClN₆O₇S
• Molecular Weight: 420.78
• CAS Registry Number: 135397-30-7
• SMILES: C2=C(OC)N=C(NC(N[S](C1=C(C(O)=O)C(=N[N]1C)Cl)(=O)=O)=O)N=C2OC
• InChI: 1S/C12H13ClN6O7S/c1-19-9(7(10(20)21)8(13)17-19)27(23,24)18-12(22)16-11-14-5(25-2)4-6(15-11)26-3/h4H,1-3H3,(H,20,21)(H2,14,15,16,18,22)
• InChIKey: LXKOADMMGWXPJQ-UHFFFAOYSA-N

Properties

• Density: 1.791g/cm³ (Cal.)