Sodium ion → 2-Chloro-8-(2,2-dimethyl-4-oxetan-3-ylpiperazin-1-ylmethyl)-9-methyl-6-morpholin-4-yl-9H-purine
Reaction equation
[C:32]([O:33][BH-:34]([O:35][C:36](=[O:37])[CH3:38])[O:39][C:40](=[O:41])[CH3:42])(=[O:43])[CH3:44].[Cl:1][c:2]1[n:3][c:4]([N:21]2[CH2:22][CH2:23][O:24][CH2:25][CH2:26]2)[c:5]2[n:6][c:7]([CH2:12][N:13]3[C:14]([CH3:19])([CH3:20])[CH2:15][NH:16][CH2:17][CH2:18]3)[n:8]([CH3:11])[c:9]2[n:10]1.[Na+:45].[O:27]1[CH2:28][C:29](=[O:31])[CH2:30]1>>[Cl:1][c:2]1[n:3][c:4]([N:21]2[CH2:22][CH2:23][O:24][CH2:25][CH2:26]2)[c:5]2[n:6][c:7]([CH2:12][N:13]3[C:14]([CH3:19])([CH3:20])[CH2:15][N:16]([CH:29]4[CH2:28][O:27][CH2:30]4)[CH2:17][CH2:18]3)[n:8]([CH3:11])[c:9]2[n:10]1Participants
5
Sources & evidence
- ORD record
- ord-3754edc0dd034f20bfeada2881d1dd55
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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