Hydroxide → 2-(4-((2-Amino-4-methyl-6-(pentylamino)pyrimidin-5-yl)methyl)phenyl)acetonitrile
Reaction equation
[CH2:45]([CH2:46][CH2:47][CH2:48][CH3:49])[NH2:50].[CH2:68]1[O:69][CH2:70][CH2:71][CH2:72]1.[CH3:53][CH2:54][CH2:55][CH2:56][O:57][C:58](=[O:59])[CH3:60].[CH3:61][c:62]1[cH:63][cH:64][cH:65][cH:66][cH:67]1.[Li+:52].[NH2:8][c:9]1[n:10][c:11]([CH3:44])[c:12]([CH2:34][c:35]2[cH:36][cH:37][c:38]([CH2:41][C:42]#[N:43])[cH:39][cH:40]2)[c:13]([O:15][S:16]([c:17]2[c:18]([CH:19]([CH3:20])[CH3:21])[cH:22][c:23]([CH:24]([CH3:25])[CH3:26])[cH:27][c:28]2[CH:29]([CH3:30])[CH3:31])(=[O:32])=[O:33])[n:14]1.[OH-:51].[OH:1][C:2]([C:3]([F:4])([F:5])[F:6])=[O:7]>>[NH2:8][c:9]1[n:10][c:11]([CH3:44])[c:12]([CH2:34][c:35]2[cH:36][cH:37][c:38]([CH2:41][C:42]#[N:43])[cH:39][cH:40]2)[c:13]([NH:50][CH2:45][CH2:46][CH2:47][CH2:48][CH3:49])[n:14]1Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-22fafea1212c4446b691bb18a097e2cc
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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