1H-Imidazole-2-carboxamide, 4-[[4-[4-[[(2S)-2-[bis(ethylthio)methyl]-1-pyrrolidinyl]carbonyl]-2-methoxy- 5-nitrophenoxy]-1-oxobutyl]amino]-N-[3-(dimethylamino)propyl]-1-methyl -

Base Information

• Chemical Name: 1H-Imidazole-2-carboxamide, 4-[[4-[4-[[(2S)-2-[bis(ethylthio)methyl]-1-pyrrolidinyl]carbonyl]-2-methoxy- 5-nitrophenoxy]-1-oxobutyl]amino]-N-[3-(dimethylamino)propyl]-1-methyl -
• CAS No.: 463326-48-9
• Molecular Formula: C31H47N7O7S2
• Molecular Weight: 693.889
• Mol file: 463326-48-9.mol

Synonyms:

Chemical Property of 1H-Imidazole-2-carboxamide, 4-[[4-[4-[[(2S)-2-[bis(ethylthio)methyl]-1-pyrrolidinyl]carbonyl]-2-methoxy- 5-nitrophenoxy]-1-oxobutyl]amino]-N-[3-(dimethylamino)propyl]-1-methyl -

Chemical Property:

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of 1H-Imidazole-2-carboxamide, 4-[[4-[4-[[(2S)-2-[bis(ethylthio)methyl]-1-pyrrolidinyl]carbonyl]-2-methoxy- 5-nitrophenoxy]-1-oxobutyl]amino]-N-[3-(dimethylamino)propyl]-1-methyl -

There total 8 articles about 1H-Imidazole-2-carboxamide, 4-[[4-[4-[[(2S)-2-[bis(ethylthio)methyl]-1-pyrrolidinyl]carbonyl]-2-methoxy- 5-nitrophenoxy]-1-oxobutyl]amino]-N-[3-(dimethylamino)propyl]-1-methyl - 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:

N-[3-(dimethylamino)propyl]-1-methyl-4-nitroimidazole-2-carboxamide (128484-08-2) → 4-(4-{4-[2-(bis-ethylsulfanyl-methyl)-pyrrolidine-1-carbonyl]-2-methoxy-5-nitro-phenoxy}-butyrylamino)-1-methyl-1H-imidazole-2-carboxylic acid (3-dimethylamino-propyl)-amide (463326-48-9)

Guidance literature:

Multi-step reaction with 2 steps

1: hydrogen / 10 percent Pd/C / methanol / 2 h / 20 °C / 2585.74 Torr

2: hydroxybenzotriazole; EDCI / dimethylformamide / 12 h / 20 °C

With hydrogen; benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; palladium on activated charcoal; In methanol; N,N-dimethyl-formamide;

DOI:10.1515/HC.2002.8.1.19

Reference yield:

4-Amino-1-methyl-1H-imidazole-2-carboxylic acid (3-dimethylamino-propyl)-amide (160751-31-5) + (2S)-N-{5-methoxy-4-[3-(carboxy)propyloxy]-2-nitrobenzoyl}pyrrolidine-2-carboxaldehyde diethyl dithioacetal (219931-70-1) → 4-(4-{4-[2-(bis-ethylsulfanyl-methyl)-pyrrolidine-1-carbonyl]-2-methoxy-5-nitro-phenoxy}-butyrylamino)-1-methyl-1H-imidazole-2-carboxylic acid (3-dimethylamino-propyl)-amide (463326-48-9)

Guidance literature:

With benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In N,N-dimethyl-formamide; at 20 ℃; for 12h;

DOI:10.1515/HC.2002.8.1.19

Reference yield:

vanillin (121-33-5,8014-42-4) → 4-(4-{4-[2-(bis-ethylsulfanyl-methyl)-pyrrolidine-1-carbonyl]-2-methoxy-5-nitro-phenoxy}-butyrylamino)-1-methyl-1H-imidazole-2-carboxylic acid (3-dimethylamino-propyl)-amide (463326-48-9)

Guidance literature:

Multi-step reaction with 7 steps

1: K₂CO₃ / tetrahydrofuran

2: HNO₃; SnCl₄ / CH₂Cl₂

3: aq. sodium chlorite; sulfamic acid

4: SO₂Cl₂ / benzene / 2 h / 20 °C

5: Et₃N / CH₂Cl₂ / 1 h / 0 °C

6: aq. NaOH / ethanol / 18 h / 50 °C

7: hydroxybenzotriazole; EDCI / dimethylformamide / 12 h / 20 °C

With sodium hydroxide; sodium chlorite; sulfuryl dichloride; aminosulfonic acid; nitric acid; tin(IV) chloride; potassium carbonate; benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; triethylamine; In tetrahydrofuran; ethanol; dichloromethane; N,N-dimethyl-formamide; benzene;

DOI:10.1515/HC.2002.8.1.19

upstream raw materials:

4-Amino-1-methyl-1H-imidazole-2-carboxylic acid (3-dimethylamino-propyl)-amide

(2S)-N-{5-methoxy-4-[3-(carboxy)propyloxy]-2-nitrobenzoyl}pyrrolidine-2-carboxaldehyde diethyl dithioacetal

N-[3-(dimethylamino)propyl]-1-methyl-4-nitroimidazole-2-carboxamide

vanillin