2-[[[4-[[(4,6-Dimethyl-2-Pyrimidinyl)Amino]Sulphonyl]Phenyl]Amino]Carbonyl]Benzoic Acid
[CAS# 94134-30-2]

Identification

• Name: 2-[[[4-[[(4,6-Dimethyl-2-Pyrimidinyl)Amino]Sulphonyl]Phenyl]Amino]Carbonyl]Benzoic Acid
• Synonyms: 2-[[[4-[(4,6-Dimethyl-2-Pyrimidinyl)Sulfamoyl]Phenyl]Amino]-Oxomethyl]Benzoic Acid; Af-614/30832043
• Molecular Formula: C₂₀H₁₈N₄O₅S
• Molecular Weight: 426.45
• CAS Registry Number: 94134-30-2
• EINECS: 302-798-9
• SMILES: C2=C([S](=O)(=O)NC1=NC(=CC(=N1)C)C)C=CC(=C2)NC(=O)C3=CC=CC=C3C(=O)O
• InChI: 1S/C20H18N4O5S/c1-12-11-13(2)22-20(21-12)24-30(28,29)15-9-7-14(8-10-15)23-18(25)16-5-3-4-6-17(16)19(26)27/h3-11H,1-2H3,(H,23,25)(H,26,27)(H,21,22,24)
• InChIKey: ASNQBPSYZGXIDK-UHFFFAOYSA-N

Properties

• Density: 1.476g/cm³ (Cal.)