3-({[5-(3-Chlorophenyl)-2-Furoyl]Carbamothioyl}Amino)-4-Methylbenzoic Acid
[CAS# 461403-24-7]

Identification

• Name: 3-({[5-(3-Chlorophenyl)-2-Furoyl]Carbamothioyl}Amino)-4-Methylbenzoic Acid
• Molecular Formula: C₂₀H₁₅ClN₂O₄S
• Molecular Weight: 414.86
• CAS Registry Number: 461403-24-7
• SMILES: O=C(c2oc(c1cc(Cl)ccc1)cc2)NC(=S)Nc3cc(C(=O)O)ccc3C
• InChI: 1S/C20H15ClN2O4S/c1-11-5-6-13(19(25)26)10-15(11)22-20(28)23-18(24)17-8-7-16(27-17)12-3-2-4-14(21)9-12/h2-10H,1H3,(H,25,26)(H2,22,23,24,28)
• InChIKey: MPDGAJNQJQSGJQ-UHFFFAOYSA-N

Properties

• Density: 1.443g/cm³ (Cal.)
• Refractive index: 1.69 (Cal.)