3,5-Dichloro-2-({[(3-Methylphenoxy)Acetyl]Carbamothioyl}Amino)Benzoic Acid
[CAS# 533921-27-6]

Identification

• Name: 3,5-Dichloro-2-({[(3-Methylphenoxy)Acetyl]Carbamothioyl}Amino)Benzoic Acid
• Molecular Formula: C₁₇H₁₄Cl₂N₂O₄S
• Molecular Weight: 413.28
• CAS Registry Number: 533921-27-6
• SMILES: Clc2cc(Cl)cc(c2NC(=S)NC(=O)COc1cc(ccc1)C)C(=O)O
• InChI: 1S/C17H14Cl2N2O4S/c1-9-3-2-4-11(5-9)25-8-14(22)20-17(26)21-15-12(16(23)24)6-10(18)7-13(15)19/h2-7H,8H2,1H3,(H,23,24)(H2,20,21,22,26)
• InChIKey: REWXMHNTQBFXTO-UHFFFAOYSA-N

Properties

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