Thioacetic acid S-({3,5-bis-[(2-acetylsulfanyl-acetylamino)-methyl]-2,4,6-triethyl-benzylcarbamoyl}-methyl) ester

Base Information

• Chemical Name: Thioacetic acid S-({3,5-bis-[(2-acetylsulfanyl-acetylamino)-methyl]-2,4,6-triethyl-benzylcarbamoyl}-methyl) ester
• CAS No.: 220472-98-0
• Molecular Formula: C₂₇H₃₉N₃O₆S₃
• Molecular Weight: 597.821

Synonyms:Thioacetic acid S-({3,5-bis-[(2-acetylsulfanyl-acetylamino)-methyl]-2,4,6-triethyl-benzylcarbamoyl}-methyl) ester

Chemical Property of Thioacetic acid S-({3,5-bis-[(2-acetylsulfanyl-acetylamino)-methyl]-2,4,6-triethyl-benzylcarbamoyl}-methyl) ester

Chemical Property:

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Technology Process of Thioacetic acid S-({3,5-bis-[(2-acetylsulfanyl-acetylamino)-methyl]-2,4,6-triethyl-benzylcarbamoyl}-methyl) ester

There total 5 articles about Thioacetic acid S-({3,5-bis-[(2-acetylsulfanyl-acetylamino)-methyl]-2,4,6-triethyl-benzylcarbamoyl}-methyl) ester 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: 95.0%

tiolacetic acid (507-09-5) + N-{3,5-Bis-[(2-chloro-acetylamino)-methyl]-2,4,6-triethyl-benzyl}-2-chloro-acetamide (220472-97-9) → Thioacetic acid S-({3,5-bis-[(2-acetylsulfanyl-acetylamino)-methyl]-2,4,6-triethyl-benzylcarbamoyl}-methyl) ester (220472-98-0)

Guidance literature:

With triethylamine; In dichloromethane; at 0 ℃;

DOI:10.1021/jo982166c

Reference yield:

1,3,5-triethylbenzene (102-25-0) → Thioacetic acid S-({3,5-bis-[(2-acetylsulfanyl-acetylamino)-methyl]-2,4,6-triethyl-benzylcarbamoyl}-methyl) ester (220472-98-0)

Guidance literature:

Multi-step reaction with 5 steps

1: 60 percent / HBr / acetic acid / Heating

2: 93 percent / NaN₃ / dimethylformamide / 80 °C

3: BH₃-THF / tetrahydrofuran / Heating

4: 51 percent / NEt₃ / methanol / 0 °C

5: 95 percent / NEt₃ / CH₂Cl₂ / 0 °C

With sodium azide; borane-THF; hydrogen bromide; triethylamine; In tetrahydrofuran; methanol; dichloromethane; acetic acid; N,N-dimethyl-formamide;

DOI:10.1021/jo982166c

Reference yield:

1,3,5-tris(bromomethyl)-2,4,6-triethylbenzene (181058-08-2) → Thioacetic acid S-({3,5-bis-[(2-acetylsulfanyl-acetylamino)-methyl]-2,4,6-triethyl-benzylcarbamoyl}-methyl) ester (220472-98-0)

Guidance literature:

Multi-step reaction with 4 steps

1: 93 percent / NaN₃ / dimethylformamide / 80 °C

2: BH₃-THF / tetrahydrofuran / Heating

3: 51 percent / NEt₃ / methanol / 0 °C

4: 95 percent / NEt₃ / CH₂Cl₂ / 0 °C

With sodium azide; borane-THF; triethylamine; In tetrahydrofuran; methanol; dichloromethane; N,N-dimethyl-formamide;

DOI:10.1021/jo982166c

upstream raw materials:

tiolacetic acid

N-{3,5-Bis-[(2-chloro-acetylamino)-methyl]-2,4,6-triethyl-benzyl}-2-chloro-acetamide

1,3,5-triethylbenzene

1,3,5-tris(bromomethyl)-2,4,6-triethylbenzene

Downstream raw materials:

2-Mercapto-N-{2,4,6-triethyl-3,5-bis-[(2-mercapto-acetylamino)-methyl]-benzyl}-acetamide

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