Sodium ion → cis-N1-benzyl-4-{4-amino-1-[4-(4-methylpiperazino)cyclohexyl]-1H-pyrazolo[3,4-d]pyrimidin-3-yl}-2-methoxybenzamide
Reaction equation
[CH2:25]([c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1)[NH:32][C:33](=[O:34])[c:35]1[c:36]([O:44][CH3:45])[cH:37][c:38]([B:41]([OH:42])[OH:43])[cH:39][cH:40]1.[CH3:52][O:53][CH2:54][CH2:55][O:56][CH3:57].[I:1][c:2]1[n:3][n:4]([CH:12]2[CH2:13][CH2:14][CH:15]([N:18]3[CH2:19][CH2:20][N:21]([CH3:24])[CH2:22][CH2:23]3)[CH2:16][CH2:17]2)[c:5]2[n:6][cH:7][n:8][c:9]([NH2:11])[c:10]12.[Na+:46].[Na+:47].[O-:48][C:49](=[O:50])[O-:51].[OH2:58]>>[c:2]1(-[c:38]2[cH:37][c:36]([O:44][CH3:45])[c:35]([C:33]([NH:32][CH2:25][c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)=[O:34])[cH:40][cH:39]2)[n:3][n:4]([CH:12]2[CH2:13][CH2:14][CH:15]([N:18]3[CH2:19][CH2:20][N:21]([CH3:24])[CH2:22][CH2:23]3)[CH2:16][CH2:17]2)[c:5]2[n:6][cH:7][n:8][c:9]([NH2:11])[c:10]12Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-0f561589bfa64c628d22d7351aef357a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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