S-[N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-N-(4-methylbenzyl)carbamoyl]methyl O-ethyl carbonodithioate

Base Information

• Chemical Name: S-[N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-N-(4-methylbenzyl)carbamoyl]methyl O-ethyl carbonodithioate
• CAS No.: 1246368-13-7
• Molecular Formula: C₂₆H₃₁N₃O₂S₂
• Molecular Weight: 481.683
• Mol file: 1246368-13-7.mol

Synonyms:S-[N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-N-(4-methylbenzyl)carbamoyl]methyl O-ethyl carbonodithioate

Chemical Property of S-[N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-N-(4-methylbenzyl)carbamoyl]methyl O-ethyl carbonodithioate

Chemical Property:

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of S-[N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-N-(4-methylbenzyl)carbamoyl]methyl O-ethyl carbonodithioate

There total 2 articles about S-[N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-N-(4-methylbenzyl)carbamoyl]methyl O-ethyl carbonodithioate 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: 94.0%

N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-2-chloro-N-(4-metylbenzyl)acetamide (1246368-14-8) + potassium ethyl xanthogenate (140-89-6) → S-[N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-N-(4-methylbenzyl)carbamoyl]methyl O-ethyl carbonodithioate (1246368-13-7)

Guidance literature:

In acetonitrile; at 20 ℃; for 2.5h; Darkness;

DOI:10.1107/S0108270110006244

Reference yield:

3-tert-butyl-N-(4-methylbenzyl)-1-phenyl-1H-pyrazol-5-amine (1204293-70-8) → S-[N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-N-(4-methylbenzyl)carbamoyl]methyl O-ethyl carbonodithioate (1246368-13-7)

Guidance literature:

Multi-step reaction with 2 steps

1: triethylamine / dichloromethane / 20 °C / Inert atmosphere; Cooling with ice

2: acetonitrile / 20 °C / Darkness

With triethylamine; In dichloromethane; acetonitrile;

DOI:10.1016/j.tetlet.2011.05.105

Reference yield: 58.0%

S-[N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-N-(4-methylbenzyl)carbamoyl]methyl O-ethyl carbonodithioate (1246368-13-7) → C23H25N3O (1318763-24-4)

Guidance literature:

With dilauryl peroxide; In 1,2-dichloro-ethane; Inert atmosphere; Reflux;

DOI:10.1016/j.tetlet.2011.05.105

upstream raw materials:

N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-2-chloro-N-(4-metylbenzyl)acetamide

potassium ethyl xanthogenate

3-tert-butyl-N-(4-methylbenzyl)-1-phenyl-1H-pyrazol-5-amine

Downstream raw materials:

C₂₃H₂₅N₃O