4-({[3-(5-Bromo-2-Methoxyphenyl)Acryloyl]Carbamothioyl}Amino)Benzoic Acid
[CAS# 535936-56-2]

Identification

• Name: 4-({[3-(5-Bromo-2-Methoxyphenyl)Acryloyl]Carbamothioyl}Amino)Benzoic Acid
• Molecular Formula: C₁₈H₁₅BrN₂O₄S
• Molecular Weight: 435.29
• CAS Registry Number: 535936-56-2
• SMILES: Brc1cc(c(OC)cc1)C=CC(=O)NC(=S)Nc2ccc(C(=O)O)cc2
• InChI: 1S/C18H15BrN2O4S/c1-25-15-8-5-13(19)10-12(15)4-9-16(22)21-18(26)20-14-6-2-11(3-7-14)17(23)24/h2-10H,1H3,(H,23,24)(H2,20,21,22,26)
• InChIKey: MQHAGTZXLNQTLB-UHFFFAOYSA-N

Properties

• Density: 1.586g/cm³ (Cal.)
• Refractive index: 1.718 (Cal.)