Benzoic Acid → diethyl [1-[4-(2-phenyl-4-oxazolylmethoxy)benzyl]-3-(2-thienyl)-1H-pyrazol-4-yl]methylmalonate
Reaction equation
[C:33]([CH2:34][C:35](=[O:36])[O:37][CH2:38][CH3:39])(=[O:40])[O:41][CH2:42][CH3:43].[CH2:44]1[CH2:45][CH2:46][NH:47][CH2:48][CH2:49]1.[CH3:59][c:60]1[cH:61][cH:62][cH:63][cH:64][cH:65]1.[OH:50][C:51]([c:52]1[cH:53][cH:54][cH:55][cH:56][cH:57]1)=[O:58].[c:1]1(-[c:7]2[o:8][cH:9][c:10]([CH2:12][O:13][c:14]3[cH:15][cH:16][c:17]([CH2:18][n:19]4[n:20][c:21](-[c:26]5[s:27][cH:28][cH:29][cH:30]5)[c:22]([CH:24]=[O:25])[cH:23]4)[cH:31][cH:32]3)[n:11]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1(-[c:7]2[o:8][cH:9][c:10]([CH2:12][O:13][c:14]3[cH:15][cH:16][c:17]([CH2:18][n:19]4[n:20][c:21](-[c:26]5[s:27][cH:28][cH:29][cH:30]5)[c:22]([CH2:24][CH:34]([C:33](=[O:40])[O:41][CH2:42][CH3:43])[C:35](=[O:36])[O:37][CH2:38][CH3:39])[cH:23]4)[cH:31][cH:32]3)[n:11]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-a0fe184fe5fb4f70b928f6a6cf5b6825
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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