5-Iodo-2-{[(3-Propoxybenzoyl)Carbamothioyl]Amino}Benzoic Acid
[CAS# 586391-88-0]

Identification

• Name: 5-Iodo-2-{[(3-Propoxybenzoyl)Carbamothioyl]Amino}Benzoic Acid
• Molecular Formula: C₁₈H₁₇IN₂O₄S
• Molecular Weight: 484.31
• CAS Registry Number: 586391-88-0
• SMILES: Ic1ccc(c(C(=O)O)c1)NC(=S)NC(=O)c2cc(OCCC)ccc2
• InChI: 1S/C18H17IN2O4S/c1-2-8-25-13-5-3-4-11(9-13)16(22)21-18(26)20-15-7-6-12(19)10-14(15)17(23)24/h3-7,9-10H,2,8H2,1H3,(H,23,24)(H2,20,21,22,26)
• InChIKey: HFJMSZDZEWCKME-UHFFFAOYSA-N

Properties

• Density: 1.669g/cm³ (Cal.)
• Refractive index: 1.7 (Cal.)