(S)-4-(2-acetamido-4-(methylthio)butanamido)-N-(3-nitro-4-(2-(phenylthio)ethylamino)phenylsulfonyl)benzamide

Base Information

• Chemical Name: (S)-4-(2-acetamido-4-(methylthio)butanamido)-N-(3-nitro-4-(2-(phenylthio)ethylamino)phenylsulfonyl)benzamide
• CAS No.: 1258550-68-3
• Molecular Formula: C₂₈H₃₁N₅O₇S₃
• Molecular Weight: 645.781
• Mol file: 1258550-68-3.mol

Synonyms:(S)-4-(2-acetamido-4-(methylthio)butanamido)-N-(3-nitro-4-(2-(phenylthio)ethylamino)phenylsulfonyl)benzamide

Chemical Property of (S)-4-(2-acetamido-4-(methylthio)butanamido)-N-(3-nitro-4-(2-(phenylthio)ethylamino)phenylsulfonyl)benzamide

Chemical Property:

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of (S)-4-(2-acetamido-4-(methylthio)butanamido)-N-(3-nitro-4-(2-(phenylthio)ethylamino)phenylsulfonyl)benzamide

There total 11 articles about (S)-4-(2-acetamido-4-(methylthio)butanamido)-N-(3-nitro-4-(2-(phenylthio)ethylamino)phenylsulfonyl)benzamide which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 16.63%

3-nitro-4-(2-phenylsulfanylethylamino)-benzenesulfonamide (406233-13-4) + (S)-4-(2-acetamido-4-(methylthio)butanamido)benzoic acid (1355150-29-6) → (S)-4-(2-acetamido-4-(methylthio)butanamido)-N-(3-nitro-4-(2-(phenylthio)ethylamino)phenylsulfonyl)benzamide (1258550-68-3)

Guidance literature:

With dmap; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In dichloromethane; at 20 ℃; for 3h;

DOI:10.1016/j.bmcl.2011.11.101

Reference yield:

C16H22N2O4S (1367454-06-5) → (S)-4-(2-acetamido-4-(methylthio)butanamido)-N-(3-nitro-4-(2-(phenylthio)ethylamino)phenylsulfonyl)benzamide (1258550-68-3)

Guidance literature:

Multi-step reaction with 2 steps

1: methanol; sodium hydroxide / tetrahydrofuran / 2 h / 20 °C

2: dmap; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride / dichloromethane / 3 h / 20 °C

With methanol; dmap; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; sodium hydroxide; In tetrahydrofuran; dichloromethane;

DOI:10.1016/j.bmcl.2011.11.101

Reference yield:

4-fluoro-3-nitrobenzenesulfonamide (406233-31-6) → (S)-4-(2-acetamido-4-(methylthio)butanamido)-N-(3-nitro-4-(2-(phenylthio)ethylamino)phenylsulfonyl)benzamide (1258550-68-3)

Guidance literature:

Multi-step reaction with 2 steps

1: N-ethyl-N,N-diisopropylamine / dimethyl sulfoxide / 5 h / 20 °C

2: dmap; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride / dichloromethane / 3 h / 20 °C

With dmap; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; N-ethyl-N,N-diisopropylamine; In dichloromethane; dimethyl sulfoxide;

DOI:10.1016/j.bmcl.2011.11.101

upstream raw materials:

4-fluoro-3-nitrobenzenesulfonamide

3-nitro-4-(2-phenylsulfanylethylamino)-benzenesulfonamide

(S)-4-(2-acetamido-4-(methylthio)butanamido)benzoic acid

C₁₆H₂₂N₂O₄S