Ethanol → N-{3-chloro-4-[(3-fluorobenzyl)oxy]phenyl}-3-[2-(methylamino)ethoxy]-1H-pyrazolo[3,4-d]pyrimidin-4-amine
Reaction equation
[CH3:1][NH2:2].[CH3:34][CH2:35][OH:36].[Cl:3][CH2:4][CH2:5][O:6][c:7]1[n:8][nH:9][c:10]2[n:11][cH:12][n:13][c:14]([NH:16][c:17]3[cH:18][c:19]([Cl:32])[c:20]([O:23][CH2:24][c:25]4[cH:26][c:27]([F:31])[cH:28][cH:29][cH:30]4)[cH:21][cH:22]3)[c:15]12.[OH2:33]>>[CH3:1][NH:2][CH2:4][CH2:5][O:6][c:7]1[n:8][nH:9][c:10]2[n:11][cH:12][n:13][c:14]([NH:16][c:17]3[cH:18][c:19]([Cl:32])[c:20]([O:23][CH2:24][c:25]4[cH:26][c:27]([F:31])[cH:28][cH:29][cH:30]4)[cH:21][cH:22]3)[c:15]12Participants
5
Sources & evidence
- ORD record
- ord-0f8b93fc29c24c4d98f183a38fc18d92
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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