1-{3-[4-(2-Chloro-phenyl)-9-methyl-6H-1-thia-5,7,8,9a-tetraaza-cyclopenta[e]azulen-2-yl]-prop-2-ynyl}-3-propa-1,2-dienyl-1,3-dihydro-benzoimidazol-2-one

Base Information

Chemical Name:1-{3-[4-(2-Chloro-phenyl)-9-methyl-6H-1-thia-5,7,8,9a-tetraaza-cyclopenta[e]azulen-2-yl]-prop-2-ynyl}-3-propa-1,2-dienyl-1,3-dihydro-benzoimidazol-2-one
CAS No.:131637-42-8
Molecular Formula:C₂₈H₁₉ClN₆OS
Molecular Weight:523.017
Hs Code.:

Synonyms:1-{3-[4-(2-Chloro-phenyl)-9-methyl-6H-1-thia-5,7,8,9a-tetraaza-cyclopenta[e]azulen-2-yl]-prop-2-ynyl}-3-propa-1,2-dienyl-1,3-dihydro-benzoimidazol-2-one

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Chemical Property of 1-{3-[4-(2-Chloro-phenyl)-9-methyl-6H-1-thia-5,7,8,9a-tetraaza-cyclopenta[e]azulen-2-yl]-prop-2-ynyl}-3-propa-1,2-dienyl-1,3-dihydro-benzoimidazol-2-one

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Technology Process of 1-{3-[4-(2-Chloro-phenyl)-9-methyl-6H-1-thia-5,7,8,9a-tetraaza-cyclopenta[e]azulen-2-yl]-prop-2-ynyl}-3-propa-1,2-dienyl-1,3-dihydro-benzoimidazol-2-one

There total 4 articles about 1-{3-[4-(2-Chloro-phenyl)-9-methyl-6H-1-thia-5,7,8,9a-tetraaza-cyclopenta[e]azulen-2-yl]-prop-2-ynyl}-3-propa-1,2-dienyl-1,3-dihydro-benzoimidazol-2-one 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: 44.0%

: 67860-41-7
4-(2-chlorophenyl)2-iodo-9-methyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine

: 131637-20-2
1,3-dihydro-1-(1,2-propadienyl)-3-(2-propynyl)-2H-benzimidazol-2-one

: 131637-42-8
1-{3-[4-(2-Chloro-phenyl)-9-methyl-6H-1-thia-5,7,8,9a-tetraaza-cyclopenta[e]azulen-2-yl]-prop-2-ynyl}-3-propa-1,2-dienyl-1,3-dihydro-benzoimidazol-2-one

Guidance literature:: With copper(l) iodide; palladium diacetate; triethylamine; triphenylphosphine; In N,N-dimethyl-formamide; for 72h; Ambient temperature;
DOI:10.1021/jm00107a048

Reference yield:

: 67860-46-2
5-(2-chlorophenyl)-2-hydrazino-7-iodo-3H-thieno<2,3-e><1,4>diazepine

: 131637-42-8
1-{3-[4-(2-Chloro-phenyl)-9-methyl-6H-1-thia-5,7,8,9a-tetraaza-cyclopenta[e]azulen-2-yl]-prop-2-ynyl}-3-propa-1,2-dienyl-1,3-dihydro-benzoimidazol-2-one

Guidance literature:: Multi-step reaction with 2 steps

1: 74.5 percent / p-TSA / ethyl acetate / 0.5 h / Heating

2: 44 percent / PPh₃, CuI, Et₃N, palladium acetate / dimethylformamide / 72 h / Ambient temperature

With copper(l) iodide; palladium diacetate; toluene-4-sulfonic acid; triethylamine; triphenylphosphine; In ethyl acetate; N,N-dimethyl-formamide;
DOI:10.1021/jm00107a048

Reference yield:

: 67860-47-3
5-(2-chlorophenyl)-1,3-dihydro-7-iodo-2H-thieno<2,3-e><1,4>diazepin-2-thione

: 131637-42-8
1-{3-[4-(2-Chloro-phenyl)-9-methyl-6H-1-thia-5,7,8,9a-tetraaza-cyclopenta[e]azulen-2-yl]-prop-2-ynyl}-3-propa-1,2-dienyl-1,3-dihydro-benzoimidazol-2-one

Guidance literature:: Multi-step reaction with 3 steps

1: hydrazine / tetrahydrofuran / 0.5 h / Ambient temperature

2: 74.5 percent / p-TSA / ethyl acetate / 0.5 h / Heating

3: 44 percent / PPh₃, CuI, Et₃N, palladium acetate / dimethylformamide / 72 h / Ambient temperature

With copper(l) iodide; palladium diacetate; toluene-4-sulfonic acid; triethylamine; triphenylphosphine; hydrazine; In tetrahydrofuran; ethyl acetate; N,N-dimethyl-formamide;
DOI:10.1021/jm00107a048