4-Chloro-3-{[(3-Methoxybenzoyl)Carbamothioyl]Amino}Benzoic Acid
[CAS# 532954-01-1]

Identification

• Name: 4-Chloro-3-{[(3-Methoxybenzoyl)Carbamothioyl]Amino}Benzoic Acid
• Synonyms: 4-chloro-3-({[(3-methoxybenzoyl)amino]carbonothioyl}amino)benzoic acid; 4-chloro-3-({[(3-methoxyphenyl)carbonyl]carbamothioyl}amino)benzoic acid
• Molecular Formula: C₁₆H₁₃ClN₂O₄S
• Molecular Weight: 364.80
• CAS Registry Number: 532954-01-1
• SMILES: Clc2ccc(cc2NC(=S)NC(=O)c1cccc(OC)c1)C(=O)O
• InChI: 1S/C16H13ClN2O4S/c1-23-11-4-2-3-9(7-11)14(20)19-16(24)18-13-8-10(15(21)22)5-6-12(13)17/h2-8H,1H3,(H,21,22)(H2,18,19,20,24)
• InChIKey: QWJZOGHDIFBKEO-UHFFFAOYSA-N

Properties

• Density: 1.476g/cm³ (Cal.)
• Refractive index: 1.694 (Cal.)