N4-(3,4-ethylenedioxyphenyl)-5-fluoro-N2-(3-hydroxyphenyl)-2,4-primidinediamine → 5-fluoro-N2-(2,3-dihydro-2-(methoxycarbonyl)benzofuran-5-yl)-N4-(4-isopropoxyphenyl)-2,4-pyrimidinediamine
Reaction equation
[CH2:1]1[CH2:2][O:3][c:4]2[cH:5][cH:6][c:7]([NH:8][c:9]3[c:10]([F:11])[cH:12][n:13][c:14]([NH:15][c:16]4[cH:17][cH:18][cH:19][c:20]([OH:21])[cH:22]4)[n:23]3)[cH:24][c:25]2[O:26]1.[Cl:27][c:28]1[n:29][cH:30][c:31]([F:45])[c:32]([NH:34][c:35]2[cH:36][cH:37][c:38]([O:41][CH:42]([CH3:43])[CH3:44])[cH:39][cH:40]2)[n:33]1.[NH2:46][c:47]1[cH:48][cH:49][c:50]2[c:51]([cH:59]1)[CH2:52][CH:53]([C:55](=[O:56])[O:57][CH3:58])[O:54]2>>[c:28]1([NH:46][c:47]2[cH:48][cH:49][c:50]3[c:51]([cH:59]2)[CH2:52][CH:53]([C:55](=[O:56])[O:57][CH3:58])[O:54]3)[n:29][cH:30][c:31]([F:45])[c:32]([NH:34][c:35]2[cH:36][cH:37][c:38]([O:41][CH:42]([CH3:43])[CH3:44])[cH:39][cH:40]2)[n:33]1Participants
4
Reactant 3
Product 1
Sources & evidence
- ORD record
- ord-c664116c7e6049e2b381507e68920d73
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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