Sodium ion → Ethyl (2-{[(3,5-bis-trifluoromethyl-benzyl)-(5-bromo-pyrimidin-2-yl)-amino]-methyl}-4-trifluoromethyl-phenyl)-ethyl-carbamate
Reaction equation
[CH2:43]([CH3:44])[I:45].[CH3:47][N:48]([CH3:49])[CH:50]=[O:51].[CH3:52][CH2:53][O:54][C:55](=[O:56])[CH3:57].[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:6][N:7]([c:8]2[n:9][cH:10][c:11]([Br:14])[cH:12][n:13]2)[CH2:15][c:16]2[c:17]([NH:26][C:27]([O:28][CH2:29][CH3:30])=[O:31])[cH:18][cH:19][c:20]([C:22]([F:23])([F:24])[F:25])[cH:21]2)[cH:32][c:33]([C:35]([F:36])([F:37])[F:38])[cH:34]1)([F:39])[F:40].[H-:41].[Na+:42].[OH2:46]>>[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:6][N:7]([c:8]2[n:9][cH:10][c:11]([Br:14])[cH:12][n:13]2)[CH2:15][c:16]2[c:17]([N:26]([C:27]([O:28][CH2:29][CH3:30])=[O:31])[CH2:43][CH3:44])[cH:18][cH:19][c:20]([C:22]([F:23])([F:24])[F:25])[cH:21]2)[cH:32][c:33]([C:35]([F:36])([F:37])[F:38])[cH:34]1)([F:39])[F:40]Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-bde5420cbba943fbb1ff92fb3d324fca
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
Loading…