3-({[(2,4-Dimethylphenoxy)Acetyl]Carbamothioyl}Amino)-4-Methylbenzoic Acid
[CAS# 462097-28-5]

Identification

• Name: 3-({[(2,4-Dimethylphenoxy)Acetyl]Carbamothioyl}Amino)-4-Methylbenzoic Acid
• Molecular Formula: C₁₉H₂₀N₂O₄S
• Molecular Weight: 372.44
• CAS Registry Number: 462097-28-5
• SMILES: O=C(O)c1cc(c(cc1)C)NC(=S)NC(=O)COc2ccc(cc2C)C
• InChI: 1S/C19H20N2O4S/c1-11-4-7-16(13(3)8-11)25-10-17(22)21-19(26)20-15-9-14(18(23)24)6-5-12(15)2/h4-9H,10H2,1-3H3,(H,23,24)(H2,20,21,22,26)
• InChIKey: ODBSRYFNZHOBNU-UHFFFAOYSA-N

Properties

• Density: 1.318g/cm³ (Cal.)
• Refractive index: 1.655 (Cal.)