3-{[(5-Bromo-2-Methoxybenzoyl)Carbamothioyl]Amino}Benzoic Acid
[CAS# 433690-89-2]

Identification

• Name: 3-{[(5-Bromo-2-Methoxybenzoyl)Carbamothioyl]Amino}Benzoic Acid
• Synonyms: 3-({[(5-bromo-2-methoxybenzoyl)amino]carbonothioyl}amino)benzoic acid; 3-({[(5-bromo-2-methoxyphenyl)carbonyl]carbamothioyl}amino)benzoic acid
• Molecular Formula: C₁₆H₁₃BrN₂O₄S
• Molecular Weight: 409.25
• CAS Registry Number: 433690-89-2
• SMILES: Brc1cc(c(OC)cc1)C(=O)NC(=S)Nc2cc(C(=O)O)ccc2
• InChI: 1S/C16H13BrN2O4S/c1-23-13-6-5-10(17)8-12(13)14(20)19-16(24)18-11-4-2-3-9(7-11)15(21)22/h2-8H,1H3,(H,21,22)(H2,18,19,20,24)
• InChIKey: RDLQNEYHFDLVPH-UHFFFAOYSA-N

Properties

• Density: 1.628g/cm³ (Cal.)
• Refractive index: 1.705 (Cal.)