Dichloromethane → 2-{6-[Bis(tert-butoxycarbonyl)amino]-4-chloro-1-[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-3-yl}ethyl 4-methylbenzenesulfonate
Reaction equation
[C:19]([CH3:20])([CH3:21])([CH3:22])[O:23][C:24](=[O:25])[N:26]([C:27](=[O:28])[O:29][C:30]([CH3:31])([CH3:32])[CH3:33])[c:34]1[n:35][c:36]([Cl:57])[c:37]2[c:38]([n:39]1)[n:40]([CH2:46][c:47]1[n:48][cH:49][c:50]([CH3:56])[c:51]([O:54][CH3:55])[c:52]1[CH3:53])[n:41][c:42]2[CH2:43][CH2:44][OH:45].[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[CH3:58][N:59]([CH3:60])[c:61]1[cH:62][cH:63][n:64][cH:65][cH:66]1.[Cl:67][CH2:68][Cl:69].[c:8]1([CH3:18])[cH:9][cH:10][c:11]([S:14](=[O:15])(=[O:16])[Cl:17])[cH:12][cH:13]1>>[c:8]1([CH3:18])[cH:9][cH:10][c:11]([S:14](=[O:15])(=[O:16])[O:45][CH2:44][CH2:43][c:42]2[c:37]3[c:36]([Cl:57])[n:35][c:34]([N:26]([C:24]([O:23][C:19]([CH3:20])([CH3:21])[CH3:22])=[O:25])[C:27](=[O:28])[O:29][C:30]([CH3:31])([CH3:32])[CH3:33])[n:39][c:38]3[n:40]([CH2:46][c:47]3[n:48][cH:49][c:50]([CH3:56])[c:51]([O:54][CH3:55])[c:52]3[CH3:53])[n:41]2)[cH:12][cH:13]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-04385e2accc74a84923549f7b710d8cb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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