Sodium ion → cis-1-[4-(4-methylpiperazino)cyclohexyl]-3-(2-phenoxy-5-pyrimidinyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
Reaction equation
[CH3:53][O:54][CH2:55][CH2:56][O:57][CH3:58].[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+:47].[Na+:48].[O-:49][C:50](=[O:51])[O-:52].[O:25]([c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1)[c:32]1[n:33][cH:34][c:35]([B:38]2[O:39][C:40]([CH3:41])([CH3:42])[C:43]([CH3:44])([CH3:45])[O:46]2)[cH:36][n:37]1.[OH2:59]>>[c:2]1(-[c:35]2[cH:34][n:33][c:32]([O:25][c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)[n:37][cH:36]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-c2ab61784166411ba8ba5c7409317d7d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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