Sodium ion → 2-[(2,6-Dichlorobenzoyl)amino]-5-[4-[methyl(pyrimidin-2-yl)amino]phenyl]pent-4-enoic acid
Reaction equation
[CH2:35]1[O:36][CH2:37][CH2:38][CH2:39]1.[CH3:1][O:2][C:3]([CH:4]([CH2:5][CH:6]=[CH:7][c:8]1[cH:9][cH:10][c:11]([N:14]([c:15]2[n:16][cH:17][cH:18][cH:19][n:20]2)[CH3:21])[cH:12][cH:13]1)[NH:22][C:23]([c:24]1[c:25]([Cl:31])[cH:26][cH:27][cH:28][c:29]1[Cl:30])=[O:32])=[O:33].[Na+:41].[OH-:40].[OH2:34]>>[O:2]=[C:3]([CH:4]([CH2:5][CH:6]=[CH:7][c:8]1[cH:9][cH:10][c:11]([N:14]([c:15]2[n:16][cH:17][cH:18][cH:19][n:20]2)[CH3:21])[cH:12][cH:13]1)[NH:22][C:23]([c:24]1[c:25]([Cl:31])[cH:26][cH:27][cH:28][c:29]1[Cl:30])=[O:32])[OH:33]Participants
6
Sources & evidence
- ORD record
- ord-aee1b0fd86ba41b1af1a8ba2e4628e09
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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