3-({[5-(4-Bromophenyl)-2-Furoyl]Carbamothioyl}Amino)Benzoic Acid
[CAS# 461402-58-4]

Identification

• Name: 3-({[5-(4-Bromophenyl)-2-Furoyl]Carbamothioyl}Amino)Benzoic Acid
• Synonyms: 3-[({[5-(4-bromophenyl)-2-furoyl]amino}carbonothioyl)amino]benzoic acid; 3-[({[5-(4-bromophenyl)furan-2-yl]carbonyl}carbamothioyl)amino]benzoic acid
• Molecular Formula: C₁₉H₁₃BrN₂O₄S
• Molecular Weight: 445.29
• CAS Registry Number: 461402-58-4
• SMILES: O=C(c2oc(c1ccc(Br)cc1)cc2)NC(=S)Nc3cc(C(=O)O)ccc3
• InChI: 1S/C19H13BrN2O4S/c20-13-6-4-11(5-7-13)15-8-9-16(26-15)17(23)22-19(27)21-14-3-1-2-12(10-14)18(24)25/h1-10H,(H,24,25)(H2,21,22,23,27)
• InChIKey: VFDFLLHJYRZBAK-UHFFFAOYSA-N

Properties

• Density: 1.617g/cm³ (Cal.)
• Refractive index: 1.712 (Cal.)