Acetic Acid → [1-(3,5-Diethoxy-4-fluoro-benzyl)-piperidin-4-yl]-(5-methanesulfonyl-pyridin-2-yl)-amine
Reaction equation
[C:46]([BH3-:47])#[N:48].[CH2:18]([CH3:19])[O:20][c:21]1[cH:22][c:23]([CH:24]=[O:25])[cH:26][c:27]([O:30][CH2:31][CH3:32])[c:28]1[F:29].[CH2:33]([N:34]([CH:35]([CH3:36])[CH3:37])[CH:38]([CH3:39])[CH3:40])[CH3:41].[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8]([NH:11][CH:12]2[CH2:13][CH2:14][NH:15][CH2:16][CH2:17]2)[n:9][cH:10]1.[CH3:42][C:43](=[O:44])[OH:45].[CH3:56][CH2:57][OH:58].[Na+:49].[Na+:50].[Na+:51].[O-:52][C:53](=[O:54])[O-:55].[OH2:59]>>[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8]([NH:11][CH:12]2[CH2:13][CH2:14][N:15]([CH2:24][c:23]3[cH:22][c:21]([O:20][CH2:18][CH3:19])[c:28]([F:29])[c:27]([O:30][CH2:31][CH3:32])[cH:26]3)[CH2:16][CH2:17]2)[n:9][cH:10]1Participants
10
Reactant 9
Product 1
Sources & evidence
- ORD record
- ord-22e8088b62ec462a99430046ef3d54c3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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