3-{[(Phenoxyacetyl)Carbamothioyl]Amino}Benzoic Acid
[CAS# 462602-90-0]

Identification

• Name: 3-{[(Phenoxyacetyl)Carbamothioyl]Amino}Benzoic Acid
• Molecular Formula: C₁₆H₁₄N₂O₄S
• Molecular Weight: 330.36
• CAS Registry Number: 462602-90-0
• SMILES: O=C(O)c1cc(ccc1)NC(=S)NC(=O)COc2ccccc2
• InChI: 1S/C16H14N2O4S/c19-14(10-22-13-7-2-1-3-8-13)18-16(23)17-12-6-4-5-11(9-12)15(20)21/h1-9H,10H2,(H,20,21)(H2,17,18,19,23)
• InChIKey: ZAWAJIKVTPMUSP-UHFFFAOYSA-N

Properties

• Density: 1.413g/cm³ (Cal.)
• Refractive index: 1.689 (Cal.)