Ethyl Acetate → 4'-{[2-Methyl-5-oxo-7-propyl-4-(3,3,3-trifluoro-2-hydroxypropyl)-4,5-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]methyl}biphenyl-2-carbonitrile
Reaction equation
[Br:30][CH2:31][CH:32]([C:33]([F:34])([F:35])[F:36])[OH:37].[C:38](=[O:39])([O-:40])[O-:41].[CH3:1][c:2]1[n:3][n:4]2[c:5]([nH:6][c:7](=[O:28])[c:8]([CH2:13][c:14]3[cH:15][cH:16][c:17](-[c:20]4[c:21]([C:26]#[N:27])[cH:22][cH:23][cH:24][cH:25]4)[cH:18][cH:19]3)[c:9]2[CH2:10][CH2:11][CH3:12])[n:29]1.[CH3:44][N:45]([CH3:46])[C:47](=[O:48])[CH3:49].[CH3:50][CH2:51][O:52][C:53](=[O:54])[CH3:55].[Cs+:42].[Cs+:43]>>[CH3:1][c:2]1[n:3][n:4]2[c:5]([n:6]([CH2:31][CH:32]([C:33]([F:34])([F:35])[F:36])[OH:37])[c:7](=[O:28])[c:8]([CH2:13][c:14]3[cH:15][cH:16][c:17](-[c:20]4[c:21]([C:26]#[N:27])[cH:22][cH:23][cH:24][cH:25]4)[cH:18][cH:19]3)[c:9]2[CH2:10][CH2:11][CH3:12])[n:29]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-56cfb341c1094b5387c8958196bb3fa6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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