3-{[(2-Chlorobenzoyl)Carbamothioyl]Amino}-2-Methylbenzoic Acid
[CAS# 434304-94-6]

Identification

• Name: 3-{[(2-Chlorobenzoyl)Carbamothioyl]Amino}-2-Methylbenzoic Acid
• Synonyms: 3-({[(2-chlorobenzoyl)amino]carbonothioyl}amino)-2-methylbenzoic acid; 3-({[(2-chlorophenyl)carbonyl]carbamothioyl}amino)-2-methylbenzoic acid
• Molecular Formula: C₁₆H₁₃ClN₂O₃S
• Molecular Weight: 348.80
• CAS Registry Number: 434304-94-6
• SMILES: O=C(c1ccccc1Cl)NC(=S)Nc2cccc(C(=O)O)c2C
• InChI: 1S/C16H13ClN2O3S/c1-9-10(15(21)22)6-4-8-13(9)18-16(23)19-14(20)11-5-2-3-7-12(11)17/h2-8H,1H3,(H,21,22)(H2,18,19,20,23)
• InChIKey: ODIZQJVJCRIONA-UHFFFAOYSA-N

Properties

• Density: 1.457g/cm³ (Cal.)
• Refractive index: 1.705 (Cal.)