Acetic Acid → 4-(8-(3-(1-(4-methoxybenzyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl)pyridin-2-ylamino)-7-methylquinazolin-4-ylamino)benzonitrile
Reaction equation
[C:65]([OH:66])(=[O:67])[CH3:68].[CH2:60]1[O:61][CH2:62][CH2:63][CH2:64]1.[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][n:8]2[n:9][cH:10][c:11]3[c:12]2[n:13][cH:14][n:15][c:16]3-[c:17]2[c:18]([F:23])[n:19][cH:20][cH:21][cH:22]2)[cH:24][cH:25]1.[CH3:47][Si:48]([N-:49][Si:50]([CH3:51])([CH3:52])[CH3:53])([CH3:54])[CH3:55].[CH3:58][OH:59].[CH3:69][OH:70].[Li+:56].[NH2:26][c:27]1[c:28]([CH3:46])[cH:29][cH:30][c:31]2[c:32]([NH:37][c:38]3[cH:39][cH:40][c:41]([C:42]#[N:43])[cH:44][cH:45]3)[n:33][cH:34][n:35][c:36]12.[NH3:57]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][n:8]2[n:9][cH:10][c:11]3[c:12]2[n:13][cH:14][n:15][c:16]3-[c:17]2[c:18]([NH:26][c:27]3[c:28]([CH3:46])[cH:29][cH:30][c:31]4[c:32]([NH:37][c:38]5[cH:39][cH:40][c:41]([C:42]#[N:43])[cH:44][cH:45]5)[n:33][cH:34][n:35][c:36]34)[n:19][cH:20][cH:21][cH:22]2)[cH:24][cH:25]1Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-e525bd3da2ca4750bbae0416cd16c645
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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