4-Chloro-3-({[(4-Methylphenoxy)Acetyl]Carbamothioyl}Amino)Benzoic Acid
[CAS# 535945-48-3]

Identification

• Name: 4-Chloro-3-({[(4-Methylphenoxy)Acetyl]Carbamothioyl}Amino)Benzoic Acid
• Molecular Formula: C₁₇H₁₅ClN₂O₄S
• Molecular Weight: 378.83
• CAS Registry Number: 535945-48-3
• SMILES: Clc2ccc(cc2NC(=S)NC(=O)COc1ccc(cc1)C)C(=O)O
• InChI: 1S/C17H15ClN2O4S/c1-10-2-5-12(6-3-10)24-9-15(21)20-17(25)19-14-8-11(16(22)23)4-7-13(14)18/h2-8H,9H2,1H3,(H,22,23)(H2,19,20,21,25)
• InChIKey: XQRKRTIFRGQOFN-UHFFFAOYSA-N

Properties

• Density: 1.446g/cm³ (Cal.)
• Refractive index: 1.679 (Cal.)