2-{[(5-Chloro-2-Methoxybenzoyl)Carbamothioyl]Amino}-3,5-Diiodobenzoic Acid
[CAS# 535947-59-2]

Identification

• Name: 2-{[(5-Chloro-2-Methoxybenzoyl)Carbamothioyl]Amino}-3,5-Diiodobenzoic Acid
• Molecular Formula: C₁₆H₁₁ClI₂N₂O₄S
• Molecular Weight: 616.60
• CAS Registry Number: 535947-59-2
• SMILES: Clc1cc(c(OC)cc1)C(=O)NC(=S)Nc2c(C(=O)O)cc(I)cc2I
• InChI: 1S/C16H11ClI2N2O4S/c1-25-12-3-2-7(17)4-9(12)14(22)21-16(26)20-13-10(15(23)24)5-8(18)6-11(13)19/h2-6H,1H3,(H,23,24)(H2,20,21,22,26)
• InChIKey: GLSIWODVVQFMSR-UHFFFAOYSA-N

Properties

• Density: 2.117g/cm³ (Cal.)
• Refractive index: 1.767 (Cal.)