3-{[(2-Methoxybenzoyl)Carbamothioyl]Amino}-4-Methylbenzoic Acid
[CAS# 433691-40-8]

Identification

• Name: 3-{[(2-Methoxybenzoyl)Carbamothioyl]Amino}-4-Methylbenzoic Acid
• Synonyms: 3-({[(2-methoxybenzoyl)amino]carbonothioyl}amino)-4-methylbenzoic acid; 3-({[(2-methoxyphenyl)carbonyl]carbamothioyl}amino)-4-methylbenzoic acid
• Molecular Formula: C₁₇H₁₆N₂O₄S
• Molecular Weight: 344.38
• CAS Registry Number: 433691-40-8
• SMILES: CC1=C(C=C(C=C1)C(=O)O)NC(=S)NC(=O)C2=CC=CC=C2OC
• InChI: 1S/C17H16N2O4S/c1-10-7-8-11(16(21)22)9-13(10)18-17(24)19-15(20)12-5-3-4-6-14(12)23-2/h3-9H,1-2H3,(H,21,22)(H2,18,19,20,24)
• InChIKey: QAKVTHMRAHWFMT-UHFFFAOYSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Refractive index: 1.678 (Cal.)