3-{[(4-Propoxybenzoyl)Carbamothioyl]Amino}Benzoic Acid
[CAS# 462095-64-3]

Identification

• Name: 3-{[(4-Propoxybenzoyl)Carbamothioyl]Amino}Benzoic Acid
• Molecular Formula: C₁₈H₁₈N₂O₄S
• Molecular Weight: 358.41
• CAS Registry Number: 462095-64-3
• SMILES: O=C(O)c1cc(ccc1)NC(=S)NC(=O)c2ccc(OCCC)cc2
• InChI: 1S/C18H18N2O4S/c1-2-10-24-15-8-6-12(7-9-15)16(21)20-18(25)19-14-5-3-4-13(11-14)17(22)23/h3-9,11H,2,10H2,1H3,(H,22,23)(H2,19,20,21,25)
• InChIKey: DXMYLILDEQNZKX-UHFFFAOYSA-N

Properties

• Density: 1.337g/cm³ (Cal.)
• Refractive index: 1.662 (Cal.)