3-{[(5-Bromo-2-Methoxybenzoyl)Carbamothioyl]Amino}-2-Methylbenzoic Acid
[CAS# 434305-20-1]

Identification

• Name: 3-{[(5-Bromo-2-Methoxybenzoyl)Carbamothioyl]Amino}-2-Methylbenzoic Acid
• Synonyms: 3-({[(5-bromo-2-methoxybenzoyl)amino]carbonothioyl}amino)-2-methylbenzoic acid; 3-({[(5-bromo-2-methoxyphenyl)carbonyl]carbamothioyl}amino)-2-methylbenzoic acid
• Molecular Formula: C₁₇H₁₅BrN₂O₄S
• Molecular Weight: 423.28
• CAS Registry Number: 434305-20-1
• SMILES: Brc1cc(c(OC)cc1)C(=O)NC(=S)Nc2cccc(C(=O)O)c2C
• InChI: 1S/C17H15BrN2O4S/c1-9-11(16(22)23)4-3-5-13(9)19-17(25)20-15(21)12-8-10(18)6-7-14(12)24-2/h3-8H,1-2H3,(H,22,23)(H2,19,20,21,25)
• InChIKey: CVBRHZUQUSBQEA-UHFFFAOYSA-N

Properties

• Density: 1.582g/cm³ (Cal.)
• Refractive index: 1.692 (Cal.)