Hydrochloric Acid → 4'-{[4-(trans-4-Formylcyclohexyl)-5-oxo-7-propyl-4,5-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]methyl}biphenyl-2-carbonitrile
Reaction equation
[CH3:37][CH2:38][N:39]([CH2:40][CH3:41])[CH2:42][CH3:43].[CH3:55][S:56](=[O:57])[CH3:58].[ClH:54].[OH:1][CH2:2][CH:3]1[CH2:4][CH2:5][CH:6]([n:9]2[c:10]3[n:11]([c:12]([CH2:31][CH2:32][CH3:33])[c:13]([CH2:16][c:17]4[cH:18][cH:19][c:20](-[c:23]5[c:24]([C:29]#[N:30])[cH:25][cH:26][cH:27][cH:28]5)[cH:21][cH:22]4)[c:14]2=[O:15])[n:34][cH:35][n:36]3)[CH2:7][CH2:8]1.[S:50](=[O:51])(=[O:52])=[O:53].[n:44]1[cH:45][cH:46][cH:47][cH:48][cH:49]1>>[O:1]=[CH:2][CH:3]1[CH2:4][CH2:5][CH:6]([n:9]2[c:10]3[n:11]([c:12]([CH2:31][CH2:32][CH3:33])[c:13]([CH2:16][c:17]4[cH:18][cH:19][c:20](-[c:23]5[c:24]([C:29]#[N:30])[cH:25][cH:26][cH:27][cH:28]5)[cH:21][cH:22]4)[c:14]2=[O:15])[n:34][cH:35][n:36]3)[CH2:7][CH2:8]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-2f2f81945c974f9c888fd1f96d023788
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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