4-Chloro-3-({[(4-Chloro-3-Methylphenoxy)Acetyl]Carbamothioyl}Amino)Benzoic Acid
[CAS# 532421-00-4]

Identification

• Name: 4-Chloro-3-({[(4-Chloro-3-Methylphenoxy)Acetyl]Carbamothioyl}Amino)Benzoic Acid
• Synonyms: 4-chloro-3-({[(4-chloro-3-methylphenoxy)acetyl]carbamothioyl}amino)benzoic acid
• Molecular Formula: C₁₇H₁₄Cl₂N₂O₄S
• Molecular Weight: 413.28
• CAS Registry Number: 532421-00-4
• SMILES: Clc2ccc(cc2NC(=S)NC(=O)COc1cc(c(Cl)cc1)C)C(=O)O
• InChI: 1S/C17H14Cl2N2O4S/c1-9-6-11(3-5-12(9)18)25-8-15(22)21-17(26)20-14-7-10(16(23)24)2-4-13(14)19/h2-7H,8H2,1H3,(H,23,24)(H2,20,21,22,26)
• InChIKey: XWFREYJZZZQSLL-UHFFFAOYSA-N

Properties

• Density: 1.509g/cm³ (Cal.)
• Refractive index: 1.683 (Cal.)