5-Iodo-2-{[(3-Methoxy-2-Naphthoyl)Carbamothioyl]Amino}Benzoic Acid
[CAS# 531515-30-7]

Identification

• Name: 5-Iodo-2-{[(3-Methoxy-2-Naphthoyl)Carbamothioyl]Amino}Benzoic Acid
• Molecular Formula: C₂₀H₁₅IN₂O₄S
• Molecular Weight: 506.31
• CAS Registry Number: 531515-30-7
• SMILES: Ic1ccc(c(C(=O)O)c1)NC(=S)NC(=O)c3cc2c(cccc2)cc3OC
• InChI: 1S/C20H15IN2O4S/c1-27-17-9-12-5-3-2-4-11(12)8-15(17)18(24)23-20(28)22-16-7-6-13(21)10-14(16)19(25)26/h2-10H,1H3,(H,25,26)(H2,22,23,24,28)
• InChIKey: FTHCTPQEDNIKFL-UHFFFAOYSA-N

Properties

• Density: 1.738g/cm³ (Cal.)
• Refractive index: 1.767 (Cal.)