Acetic Acid → 4-({[2-fluoro-3-(2-hydroxyethoxy)-5-methoxyphenyl]-(5-oxo-1-pyrimidin-2-yl-4,5-dihydro-1H-[1,2,4]triazol-3-yl)methyl}amino)benzonitrile
Reaction equation
[C:1]([Si:2]([CH3:3])([CH3:4])[O:6][CH2:7][CH2:8][O:9][c:10]1[c:11]([F:40])[c:12]([CH:18]([c:19]2[n:20][n:21](-[c:25]3[n:26][cH:27][cH:28][cH:29][n:30]3)[c:22](=[O:24])[nH:23]2)[NH:31][c:32]2[cH:33][cH:34][c:35]([C:36]#[N:37])[cH:38][cH:39]2)[cH:13][c:14]([O:16][CH3:17])[cH:15]1)([CH3:5])([CH3:41])[CH3:42].[CH3:43][C:44](=[O:45])[OH:46].[OH2:47]>>[OH:6][CH2:7][CH2:8][O:9][c:10]1[c:11]([F:40])[c:12]([CH:18]([c:19]2[n:20][n:21](-[c:25]3[n:26][cH:27][cH:28][cH:29][n:30]3)[c:22](=[O:24])[nH:23]2)[NH:31][c:32]2[cH:33][cH:34][c:35]([C:36]#[N:37])[cH:38][cH:39]2)[cH:13][c:14]([O:16][CH3:17])[cH:15]1Participants
4
Reactant 3
Product 1
Sources & evidence
- ORD record
- ord-0748378954624016a0384d50d3ef9d31
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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