[[2-[2-(Benzoyl)-4-Nitrophenyl]-4-Ethoxyphenyl]Amino]Methanethioic S-Acid
[CAS# 111093-27-7]

Identification

• Name: [[2-[2-(Benzoyl)-4-Nitrophenyl]-4-Ethoxyphenyl]Amino]Methanethioic S-Acid
• Synonyms: [[2-[2-(Benzoyl)-4-Nitro-Phenyl]-4-Ethoxy-Phenyl]Amino]Methanethioic S-Acid; [[4-Ethoxy-2-[4-Nitro-2-(Oxo-Phenylmethyl)Phenyl]Phenyl]Amino]Methanethioic S-Acid; [[2-[2-(Benzoyl)-4-Nitro-Phenyl]-4-Ethoxy-Phenyl]Amino]Thioformic Acid
• Molecular Formula: C₂₂H₁₈N₂O₅S
• Molecular Weight: 422.45
• CAS Registry Number: 111093-27-7
• SMILES: C1=C(C(=CC=C1[N+]([O-])=O)C2=CC(=CC=C2NC(S)=O)OCC)C(=O)C3=CC=CC=C3
• InChI: 1S/C22H18N2O5S/c1-2-29-16-9-11-20(23-22(26)30)18(13-16)17-10-8-15(24(27)28)12-19(17)21(25)14-6-4-3-5-7-14/h3-13H,2H2,1H3,(H2,23,26,30)
• InChIKey: OABZBKNMYFHBNZ-UHFFFAOYSA-N

Properties

• Density: 1.338g/cm³ (Cal.)