Ammonium → [1-[4-(5-methyl-2-phenyl-4-oxazolylmethoxy)benzyl]-3-(2-thienyl)-1H-pyrazol-4-yl]acetonitrile
Reaction equation
[CH2:55]([CH2:56][O:57][CH3:58])[O:59][CH3:60].[CH3:14][C:15]([CH3:16])([O-:17])[CH3:18].[CH3:20][c:21]1[c:22]([CH2:32][O:33][c:34]2[cH:35][cH:36][c:37]([CH2:38][n:39]3[n:40][c:41](-[c:46]4[s:47][cH:48][cH:49][cH:50]4)[c:42]([CH:44]=[O:45])[cH:43]3)[cH:51][cH:52]2)[n:23][c:24](-[c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[o:25]1.[CH3:61][OH:62].[Cl-:53].[K+:19].[NH4+:54].[c:1]1([CH3:2])[cH:3][cH:4][c:5]([S:6](=[O:8])(=[O:9])[CH2:10][N+:11]#[C-:7])[cH:12][cH:13]1>>[C:10](#[N:11])[CH2:44][c:42]1[c:41](-[c:46]2[s:47][cH:48][cH:49][cH:50]2)[n:40][n:39]([CH2:38][c:37]2[cH:36][cH:35][c:34]([O:33][CH2:32][c:22]3[c:21]([CH3:20])[o:25][c:24](-[c:26]4[cH:27][cH:28][cH:29][cH:30][cH:31]4)[n:23]3)[cH:52][cH:51]2)[cH:43]1Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-8767677cdb10405abbd236aa7316b1dd
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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