Ammonium → 4'-({4-[4-(1-Hydroxyethyl)benzyl]-5-oxo-7-propyl-4,5-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}methyl)biphenyl-2-carbonitrile
Reaction equation
[Br-:38].[CH3:39][Mg+:40].[CH:1](=[O:2])[c:3]1[cH:4][cH:5][c:6]([CH2:7][n:8]2[c:9]3[n:10]([c:11]([CH2:30][CH2:31][CH3:32])[c:12]([CH2:15][c:16]4[cH:17][cH:18][c:19](-[c:22]5[c:23]([C:28]#[N:29])[cH:24][cH:25][cH:26][cH:27]5)[cH:20][cH:21]4)[c:13]2=[O:14])[n:33][cH:34][n:35]3)[cH:36][cH:37]1.[Cl-:41].[NH4+:42].[O:43]1[CH2:44][CH2:45][CH2:46][CH2:47]1>>[CH:1]([OH:2])([c:3]1[cH:4][cH:5][c:6]([CH2:7][n:8]2[c:9]3[n:10]([c:11]([CH2:30][CH2:31][CH3:32])[c:12]([CH2:15][c:16]4[cH:17][cH:18][c:19](-[c:22]5[c:23]([C:28]#[N:29])[cH:24][cH:25][cH:26][cH:27]5)[cH:20][cH:21]4)[c:13]2=[O:14])[n:33][cH:34][n:35]3)[cH:36][cH:37]1)[CH3:39]Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-0c64afd63eba4117bbbcb60147e82534
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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