Ethanol → Ethyl 1-((2'-cyano(1,1'-biphenyl)-4-yl)methyl)-2-ethoxy-1H-benzimidazole-7-carboxylate

HRID 1556976Notes

Reaction equation

HRID 1556976 reaction equation
[CH3:31][CH2:32][O-:33].[CH3:35][CH2:36][OH:37].[Cl:1][c:2]1[n:3][c:4]2[c:5]([n:6]1[CH2:7][c:8]1[cH:9][cH:10][c:11](-[c:14]3[c:15]([C:20]#[N:21])[cH:16][cH:17][cH:18][cH:19]3)[cH:12][cH:13]1)[c:22]([C:26](=[O:27])[O:28][CH2:29][CH3:30])[cH:23][cH:24][cH:25]2.[Na+:34]>>[c:2]1([O:33][CH2:32][CH3:31])[n:3][c:4]2[c:5]([n:6]1[CH2:7][c:8]1[cH:9][cH:10][c:11](-[c:14]3[c:15]([C:20]#[N:21])[cH:16][cH:17][cH:18][cH:19]3)[cH:12][cH:13]1)[c:22]([C:26](=[O:27])[O:28][CH2:29][CH3:30])[cH:23][cH:24][cH:25]2

Participants

5

Reactant 4

HCID 702EthanolHCID 923Sodium ionHCID 1194401-Hydroxyethyl radicalHCID 22596779Ethyl 2-chloro-1-[(2'-cyanobiphenyl-4-yl)methyl]benzimidazole-7-carboxylate

Product 1

HCID 15434963Ethyl 1-((2'-cyano(1,1'-biphenyl)-4-yl)methyl)-2-ethoxy-1H-benzimidazole-7-carboxylate

Sources & evidence

ORD record
ord-e788fecc900b4a2bb9aa3e8853aee562
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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