Bicarbonate Ion → 4-(3-oxocyclobutyl)-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
[C:38](=[O:39])([O-:40])[OH:41].[CH3:50][C:51]#[N:52].[Na+:42].[Na+:48].[Na+:49].[OH:1][CH:2]1[CH2:3][CH:4]([n:6]2[c:7]3[n:8]([c:9]([CH2:32][CH2:33][CH3:34])[c:10]([CH2:13][c:14]4[cH:15][cH:16][c:17](-[c:20]5[c:21](-[c:26]6[n:27][o:28][c:29](=[O:31])[nH:30]6)[cH:22][cH:23][cH:24][cH:25]5)[cH:18][cH:19]4)[c:11]2=[O:12])[n:35][cH:36][n:37]3)[CH2:5]1.[S:43]([O-:44])([O-:45])(=[O:46])=[S:47]>>[O:1]=[C:2]1[CH2:3][CH:4]([n:6]2[c:7]3[n:8]([c:9]([CH2:32][CH2:33][CH3:34])[c:10]([CH2:13][c:14]4[cH:15][cH:16][c:17](-[c:20]5[c:21](-[c:26]6[n:27][o:28][c:29](=[O:31])[nH:30]6)[cH:22][cH:23][cH:24][cH:25]5)[cH:18][cH:19]4)[c:11]2=[O:12])[n:35][cH:36][n:37]3)[CH2:5]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-04fa3d36696a4a8790fbb69a70f62a0c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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