5-{[(3-Bromo-4-Methoxybenzoyl)Carbamothioyl]Amino}-2-Chlorobenzoic Acid
[CAS# 434307-81-0]

Identification

• Name: 5-{[(3-Bromo-4-Methoxybenzoyl)Carbamothioyl]Amino}-2-Chlorobenzoic Acid
• Synonyms: 5-({[(3-bromo-4-methoxybenzoyl)amino]carbonothioyl}amino)-2-chlorobenzoic acid; 5-({[(3-bromo-4-methoxyphenyl)carbonyl]carbamothioyl}amino)-2-chlorobenzoic acid
• Molecular Formula: C₁₆H₁₂BrClN₂O₄S
• Molecular Weight: 443.70
• CAS Registry Number: 434307-81-0
• SMILES: Brc1cc(ccc1OC)C(=O)NC(=S)Nc2cc(C(=O)O)c(Cl)cc2
• InChI: 1S/C16H12BrClN2O4S/c1-24-13-5-2-8(6-11(13)17)14(21)20-16(25)19-9-3-4-12(18)10(7-9)15(22)23/h2-7H,1H3,(H,22,23)(H2,19,20,21,25)
• InChIKey: BCNFFQFPLVKUHU-UHFFFAOYSA-N

Properties

• Density: 1.685g/cm³ (Cal.)
• Refractive index: 1.707 (Cal.)