3,5-Dichloro-2-({[(3,5-Dimethylphenoxy)Acetyl]Carbamothioyl}Amino)Benzoic Acid
[CAS# 535940-98-8]

Identification

• Name: 3,5-Dichloro-2-({[(3,5-Dimethylphenoxy)Acetyl]Carbamothioyl}Amino)Benzoic Acid
• Molecular Formula: C₁₈H₁₆Cl₂N₂O₄S
• Molecular Weight: 427.30
• CAS Registry Number: 535940-98-8
• SMILES: Clc2cc(Cl)cc(c2NC(=S)NC(=O)COc1cc(cc(c1)C)C)C(=O)O
• InChI: 1S/C18H16Cl2N2O4S/c1-9-3-10(2)5-12(4-9)26-8-15(23)21-18(27)22-16-13(17(24)25)6-11(19)7-14(16)20/h3-7H,8H2,1-2H3,(H,24,25)(H2,21,22,23,27)
• InChIKey: ZFRVEPGRPCYTPO-UHFFFAOYSA-N

Properties

• Density: 1.472g/cm³ (Cal.)
• Refractive index: 1.672 (Cal.)