Sodium ion → (4-Bromo-2-fluoro-benzyl)-{5-[1-(4-{3-[N,N-bis-(tert-butoxycarbonyl)aminomethyl]-phenyl)-piperidin-1-yl)-methanoyl]-pyridin-3-yl}-carbamic acid dimethyl-ethyl ester
Reaction equation
[Br:47][c:48]1[cH:49][c:50]([F:56])[c:51]([CH2:52][Br:53])[cH:54][cH:55]1.[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[cH:9][n:10][cH:11][c:12]([C:14](=[O:15])[N:16]2[CH2:17][CH2:18][CH:19]([c:22]3[cH:23][c:24]([CH2:28][N:29]([C:30](=[O:31])[O:32][C:33]([CH3:34])([CH3:35])[CH3:36])[C:37](=[O:38])[O:39][C:40]([CH3:41])([CH3:42])[CH3:43])[cH:25][cH:26][cH:27]3)[CH2:20][CH2:21]2)[cH:13]1)=[O:44].[CH3:57][N:58]([CH3:59])[CH:60]=[O:61].[H-:45].[Na+:46]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([N:7]([c:8]1[cH:9][n:10][cH:11][c:12]([C:14](=[O:15])[N:16]2[CH2:17][CH2:18][CH:19]([c:22]3[cH:23][c:24]([CH2:28][N:29]([C:30](=[O:31])[O:32][C:33]([CH3:34])([CH3:35])[CH3:36])[C:37](=[O:38])[O:39][C:40]([CH3:41])([CH3:42])[CH3:43])[cH:25][cH:26][cH:27]3)[CH2:20][CH2:21]2)[cH:13]1)[CH2:52][c:51]1[c:50]([F:56])[cH:49][c:48]([Br:47])[cH:55][cH:54]1)=[O:44]Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-2889af2d79d44981b3deff1cb0e380a9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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