4-(Dimethylamino)pyridine → 1-(3-(2-Fluoropropan-2-yl)isoxazol-5-yl)-3-(3-(6-methoxy-7-(2-methoxyethoxy)quinazolin-4-ylthio)phenyl)urea
Reaction equation
[CH3:20][O:21][c:22]1[cH:23][c:24]2[c:25]([S:37][c:38]3[cH:39][c:40]([NH2:41])[cH:42][cH:43][cH:44]3)[n:26][cH:27][n:28][c:29]2[cH:30][c:31]1[O:32][CH2:33][CH2:34][O:35][CH3:36].[CH3:54][N:55]([c:56]1[cH:57][cH:58][n:59][cH:60][cH:61]1)[CH3:62].[CH:45]([N:46]([CH:47]([CH3:48])[CH3:49])[CH2:50][CH3:51])([CH3:52])[CH3:53].[F:1][C:2]([CH3:3])([CH3:4])[c:5]1[n:6][o:7][c:8]([NH:10][C:11]([O:12][c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)=[O:19])[cH:9]1>>[F:1][C:2]([CH3:3])([CH3:4])[c:5]1[n:6][o:7][c:8]([NH:10][C:11](=[O:19])[NH:41][c:40]2[cH:39][c:38]([S:37][c:25]3[c:24]4[cH:23][c:22]([O:21][CH3:20])[c:31]([O:32][CH2:33][CH2:34][O:35][CH3:36])[cH:30][c:29]4[n:28][cH:27][n:26]3)[cH:44][cH:43][cH:42]2)[cH:9]1Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-15bad922c4b74823a5cdf540de87f5a1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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