2-{[4-ethyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide

Base Information

Chemical Name:2-{[4-ethyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide
CAS No.:585550-72-7
Molecular Formula:C₂₀H₂₃N₅OS
Molecular Weight:381.502
Hs Code.:
European Community (EC) Number:643-688-3

Synonyms:585550-72-7;VUAA3;(1-methylethyl)phenyl]acetamide;2-{[4-ethyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide;OLC12;2-[[4-Ethyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]thio]-N-[4-(1-methylethyl)phenyl]acetamide;SCHEMBL15986406;STL259618;AKOS000421057;2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-propan-2-ylphenyl)acetamide;2-[[4-Ethyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]thio]-N-[4-

Suppliers and Price of 2-{[4-ethyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
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price

Total 2 raw suppliers

Chemical Property of 2-{[4-ethyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide

Chemical Property:

XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:381.16233155
Heavy Atom Count:27
Complexity:463

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)C(C)C)C3=CC=NC=C3

Technology Process of 2-{[4-ethyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide

There total 5 articles about 2-{[4-ethyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide 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:

: 54-85-3,7640-37-1
isoniazid

: 585550-72-7
C₂₀H₂₃N₅OS

Guidance literature:: Multi-step reaction with 2 steps

1.1: 0.25 h / 150 °C / Microwave irradiation

1.2: 16 h / Reflux

2.1: caesium carbonate / acetonitrile / 16 h

With caesium carbonate; In acetonitrile;
DOI:10.1016/j.bmcl.2014.04.081

Reference yield:

: 99-88-7
4-Isopropylaniline

: 585550-72-7
C₂₀H₂₃N₅OS

Guidance literature:: Multi-step reaction with 2 steps

1: triethylamine / 2 h

2: caesium carbonate / acetonitrile / 16 h

With caesium carbonate; triethylamine; In acetonitrile;
DOI:10.1016/j.bmcl.2014.04.081

Reference yield:

: 2459-09-8
4-pyridinecarboxylic acid, methyl ester

: 585550-72-7
C₂₀H₂₃N₅OS

Guidance literature:: Multi-step reaction with 3 steps

1.1: hydrazine / 0.25 h / 150 °C / Microwave irradiation

2.1: 0.25 h / 150 °C / Microwave irradiation

2.2: 16 h / Reflux

3.1: caesium carbonate / acetonitrile / 16 h

With caesium carbonate; hydrazine; In acetonitrile;
DOI:10.1016/j.bmcl.2014.04.081