Sodium ion → 4-[4-(3-Chloro-4-fluoro-phenyl)-1-cyanomethyl-1H-imidazol-2-yl]-piperidine-1-carboxylic acid tert-butyl ester

HRID 1564483Notes

Reaction equation

HRID 1564483 reaction equation
[Br:29][CH2:30][C:31]#[N:32].[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([c:14]2[nH:15][cH:16][c:17](-[c:19]3[cH:20][c:21]([Cl:26])[c:22]([F:25])[cH:23][cH:24]3)[n:18]2)[CH2:12][CH2:13]1.[Cl:33][CH2:34][Cl:35].[Na+:28].[OH-:27]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([c:14]2[n:15]([CH2:30][C:31]#[N:32])[cH:16][c:17](-[c:19]3[cH:20][c:21]([Cl:26])[c:22]([F:25])[cH:23][cH:24]3)[n:18]2)[CH2:12][CH2:13]1

Participants

6

Reactant 5

HCID 923Sodium ionHCID 961HydroxideHCID 6344DichloromethaneHCID 11534BromoacetonitrileHCID 178451793HCID 178451793, compound

Product 1

HCID 672655344-[4-(3-Chloro-4-fluoro-phenyl)-1-cyanomethyl-1H-imidazol-2-yl]-piperidine-1-carboxylic acid tert-butyl ester

Sources & evidence

ORD record
ord-2d22ee82d57749d7a3cde86d72d6c8d7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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