Dimethylformamide → 1-(5-tert-butyl-2-methyl-2H-pyrazol-3-yl)-3-[5-fluoro-2-(3-pyrrolidin-1-ylmethyl-benzo[d]isoxazol-6-yloxy)-benzyl]-urea
Reaction equation
[CH:45]([N:46]([CH:47]([CH3:48])[CH3:49])[CH2:50][CH3:51])([CH3:52])[CH3:53].[F:1][c:2]1[cH:3][cH:4][c:5]([O:10][c:11]2[cH:12][c:13]3[c:14]([c:15]([CH2:18][N:19]4[CH2:20][CH2:21][CH2:22][CH2:23]4)[n:16][o:17]3)[cH:24][cH:25]2)[c:6]([CH2:7][NH2:8])[cH:9]1.[F:26][C:27]([F:28])([F:42])[CH2:43][O:29][C:30]([NH:31][c:32]1[n:33]([CH3:41])[n:34][c:35]([C:37]([CH3:38])([CH3:39])[CH3:40])[cH:36]1)=[O:44].[O:54]=[CH:55][N:56]([CH3:57])[CH3:58]>>[F:1][c:2]1[cH:3][cH:4][c:5]([O:10][c:11]2[cH:12][c:13]3[c:14]([c:15]([CH2:18][N:19]4[CH2:20][CH2:21][CH2:22][CH2:23]4)[n:16][o:17]3)[cH:24][cH:25]2)[c:6]([CH2:7][NH:8][C:30](=[O:29])[NH:31][c:32]2[n:33]([CH3:41])[n:34][c:35]([C:37]([CH3:38])([CH3:39])[CH3:40])[cH:36]2)[cH:9]1Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-c0bf484aac184982b74ab2102443ea85
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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