4-Aminomethyl-4'-fluoro-biphenyl-2-ol → 4-[[[4-(4-fluorophenyl)-3-hydroxyphenyl]methylamino]methylidene]-6-(furan-2-yl)isoquinoline-1,3-dione
Reaction equation
[NH2:50][CH2:51][c:52]1[cH:53][c:54]([OH:65])[c:55](-[c:58]2[cH:59][cH:60][c:61]([F:64])[cH:62][cH:63]2)[cH:56][cH:57]1.[OH:1][c:2]1[cH:3][c:4]([CH2:5][NH:6][CH:7]=[C:8]2[c:9]3[c:10]([cH:11][cH:12][c:13]([I:14])[cH:15]3)[C:16](=[O:17])[NH:18][C:19]2=[O:20])[cH:21][cH:22][c:23]1-[c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1.[o:30]1[c:31](-[c:35]2[cH:36][c:37]3[c:42]([cH:43][cH:44]2)[C:41](=[O:45])[NH:40][C:39](=[O:46])[C:38]3=[CH:47][O:48][CH3:49])[cH:32][cH:33][cH:34]1>>[o:30]1[c:31](-[c:35]2[cH:36][c:37]3[c:42]([cH:43][cH:44]2)[C:41](=[O:45])[NH:40][C:39](=[O:46])[C:38]3=[CH:47][NH:50][CH2:51][c:52]2[cH:53][c:54]([OH:65])[c:55](-[c:58]3[cH:59][cH:60][c:61]([F:64])[cH:62][cH:63]3)[cH:56][cH:57]2)[cH:32][cH:33][cH:34]1Participants
4
Sources & evidence
- ORD record
- ord-9203acd875f640a8aeb38316238482ec
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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