Acetic Acid → 2-(3-((7-Methoxy-3-(2-(methylamino)pyrimidin-4-yl)naphthalen-1-yl)amino)propyl)isoindoline-1,3-dione
Reaction equation
[C:46]([O:47][BH-:48]([O:49][C:50](=[O:51])[CH3:52])[O:53][C:54](=[O:55])[CH3:56])(=[O:57])[CH3:58].[CH3:60][CH2:61][O:62][C:63](=[O:64])[CH3:65].[CH3:66][C:67](=[O:68])[OH:69].[CH:22]([N:23]([CH2:24][CH3:25])[CH:26]([CH3:27])[CH3:28])([CH3:29])[CH3:30].[NH2:1][c:2]1[cH:3][c:4](-[c:14]2[n:15][c:16]([NH:20][CH3:21])[n:17][cH:18][cH:19]2)[cH:5][c:6]2[cH:7][cH:8][c:9]([O:12][CH3:13])[cH:10][c:11]12.[Na+:59].[O:31]=[C:32]1[N:33]([CH2:42][CH2:43][CH:44]=[O:45])[C:34](=[O:41])[c:35]2[cH:36][cH:37][cH:38][cH:39][c:40]21>>[NH:1]([c:2]1[cH:3][c:4](-[c:14]2[n:15][c:16]([NH:20][CH3:21])[n:17][cH:18][cH:19]2)[cH:5][c:6]2[cH:7][cH:8][c:9]([O:12][CH3:13])[cH:10][c:11]12)[CH2:44][CH2:43][CH2:42][N:33]1[C:32](=[O:31])[c:40]2[c:35]([cH:36][cH:37][cH:38][cH:39]2)[C:34]1=[O:41]Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-24fa0b2dc1b840cdb395f3d578cf5b59
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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