Methanol → 3'-Fluoro-4'-{[5-oxo-4-(4-oxocyclohexyl)-7-propyl-4,5-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]methyl}biphenyl-2-carbonitrile
Reaction equation
[CH3:52][OH:53].[CH3:59][CH2:60][O:61][C:62](=[O:63])[CH3:64].[O:1]1[CH2:3][CH2:2][O:4][C:5]12[CH2:6][CH2:7][CH:8]([n:11]1[c:12]3[n:13]([c:14]([CH2:34][CH2:35][CH3:36])[c:15]([CH2:18][c:19]4[c:20]([F:33])[cH:21][c:22](-[c:25]5[c:26]([C:31]#[N:32])[cH:27][cH:28][cH:29][cH:30]5)[cH:23][cH:24]4)[c:16]1=[O:17])[n:37][cH:38][n:39]3)[CH2:9][CH2:10]2.[O:54]1[CH2:55][CH2:56][CH2:57][CH2:58]1.[OH2:40].[c:41]1([CH3:42])[cH:43][cH:44][c:45]([S:46]([OH:47])(=[O:48])=[O:49])[cH:50][cH:51]1>>[O:4]=[C:5]1[CH2:6][CH2:7][CH:8]([n:11]2[c:12]3[n:13]([c:14]([CH2:34][CH2:35][CH3:36])[c:15]([CH2:18][c:19]4[c:20]([F:33])[cH:21][c:22](-[c:25]5[c:26]([C:31]#[N:32])[cH:27][cH:28][cH:29][cH:30]5)[cH:23][cH:24]4)[c:16]2=[O:17])[n:37][cH:38][n:39]3)[CH2:9][CH2:10]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-c6bd049ecfe64347bd8a907831a6a8cf
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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