Hydrochloric Acid → 4'-[(4-{trans-4-[Hydroxy(4-methoxyphenyl)methyl]cyclohexyl}-5-oxo-7-propyl-4,5-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)methyl]biphenyl-2-carbonitrile
Reaction equation
[Br:37][Mg:38][c:39]1[cH:40][cH:41][c:42]([O:45][CH3:46])[cH:43][cH:44]1.[CH:1](=[O: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.[ClH:47].[O:48]1[CH2:49][CH2:50][CH2:51][CH2:52]1>>[CH:1]([OH: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)[c:39]1[cH:40][cH:41][c:42]([O:45][CH3:46])[cH:43][cH:44]1Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-3726fd15f965445f81dd195ea4f0a751
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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