Chloride → [5-Chloro-2-(4-methyl-piperazin-1-yl)-pyridin-4-yl]-acetic acid ethyl ester
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][c:6]1[cH:7][c:8]([N:13]2[CH2:14][CH2:15][N:16]([CH3:19])[CH2:17][CH2:18]2)[n:9][cH:10][c:11]1[NH2:12])=[O:20].[CH3:29][CH2:30][O:31][C:32]([CH3:33])=[O:34].[Cl-:25].[Cl:35][Cu:36].[ClH:27].[N:21]([O-:22])=[O:23].[Na+:24].[Na+:26].[OH2:28]>>[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][c:6]1[cH:7][c:8]([N:13]2[CH2:14][CH2:15][N:16]([CH3:19])[CH2:17][CH2:18]2)[n:9][cH:10][c:11]1[Cl:25])=[O:20]Participants
9
Sources & evidence
- ORD record
- ord-640de87de1d54a9f95e6cb54d8ac7aa0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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