Hydrochloric Acid → 4-(4-oxocyclohexyl)-6-{[2'-(5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl)biphenyl-4-yl]methyl}-7-propyl[1,2,4]triazolo[1,5-a]pyrimidin-5(4H)-one
Reaction equation
[CH3:49][CH2:50][O:51][C:52](=[O:53])[CH3:54].[ClH:43].[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]([CH2:37][CH2:38][CH3:39])[c:15]([CH2:18][c:19]4[cH:20][cH:21][c:22](-[c:25]5[c:26](-[c:31]6[n:32][o:33][c:34](=[O:36])[nH:35]6)[cH:27][cH:28][cH:29][cH:30]5)[cH:23][cH:24]4)[c:16]1=[O:17])[n:40][cH:41][n:42]3)[CH2:9][CH2:10]2.[O:44]1[CH2:45][CH2:46][CH2:47][CH2:48]1>>[O:4]=[C:5]1[CH2:6][CH2:7][CH:8]([n:11]2[c:12]3[n:13]([c:14]([CH2:37][CH2:38][CH3:39])[c:15]([CH2:18][c:19]4[cH:20][cH:21][c:22](-[c:25]5[c:26](-[c:31]6[n:32][o:33][c:34](=[O:36])[nH:35]6)[cH:27][cH:28][cH:29][cH:30]5)[cH:23][cH:24]4)[c:16]2=[O:17])[n:40][cH:41][n:42]3)[CH2:9][CH2:10]1Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-bdebeb957b8e4ee590e0515193e070c6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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