Acetic Acid → [5-(2,4-Diamino-pyrimidin-5-yloxy)-4-isopropyl-2-methoxy-phenyl]-urea
Reaction equation
[CH3:22][C:23](=[O:24])[OH:25].[NH2:1][c:2]1[c:3]([O:20][CH3:21])[cH:4][c:5]([CH:17]([CH3:18])[CH3:19])[c:6]([O:7][c:8]2[c:9]([NH2:15])[n:10][c:11]([NH2:14])[n:12][cH:13]2)[cH:16]1.[Na:26][O:27][C:28]#[N:29].[OH2:30]>>[NH:1]([c:2]1[c:3]([O:20][CH3:21])[cH:4][c:5]([CH:17]([CH3:18])[CH3:19])[c:6]([O:7][c:8]2[c:9]([NH2:15])[n:10][c:11]([NH2:14])[n:12][cH:13]2)[cH:16]1)[C:28](=[O:27])[NH2:29]Participants
5
Sources & evidence
- ORD record
- ord-8dae5653f8a04e5e84b5aa6c913a032c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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