3-{[(4-Methoxybenzoyl)Carbamothioyl]Amino}-4-Methylbenzoic Acid
[CAS# 433693-57-3]

Identification

• Name: 3-{[(4-Methoxybenzoyl)Carbamothioyl]Amino}-4-Methylbenzoic Acid
• Synonyms: 3-({[(4-methoxybenzoyl)amino]carbonothioyl}amino)-4-methylbenzoic acid; 3-({[(4-methoxyphenyl)carbonyl]carbamothioyl}amino)-4-methylbenzoic acid
• Molecular Formula: C₁₇H₁₆N₂O₄S
• Molecular Weight: 344.38
• CAS Registry Number: 433693-57-3
• SMILES: O=C(O)c1cc(c(cc1)C)NC(=S)NC(=O)c2ccc(OC)cc2
• InChI: 1S/C17H16N2O4S/c1-10-3-4-12(16(21)22)9-14(10)18-17(24)19-15(20)11-5-7-13(23-2)8-6-11/h3-9H,1-2H3,(H,21,22)(H2,18,19,20,24)
• InChIKey: RVUMIPCZNMAHBI-UHFFFAOYSA-N

Properties

• Density: 1.37g/cm³ (Cal.)
• Refractive index: 1.677 (Cal.)