O-Xylene → [4-(2-Methylbenzyl)-1,3,4-oxadiazolin-5-on-2-yl]-methyl 2-(4-chlorophenyl)-3-methylbutyrate
Reaction equation
[CH3:31][CH2:32][N:33]([CH2:34][CH3:35])[CH2:36][CH3:37].[Cl:17][c:18]1[cH:19][cH:20][c:21]([CH:24]([C:25](=[O:26])[OH:27])[CH:28]([CH3:29])[CH3:30])[cH:22][cH:23]1.[Cl:1][CH2:2][c:3]1[o:4][c:5](=[O:16])[n:6]([CH2:8][c:9]2[c:10]([CH3:15])[cH:11][cH:12][cH:13][cH:14]2)[n:7]1.[c:38]1([CH3:39])[c:40]([CH3:41])[cH:42][cH:43][cH:44][cH:45]1>>[CH2:2]([c:3]1[o:4][c:5](=[O:16])[n:6]([CH2:8][c:9]2[c:10]([CH3:15])[cH:11][cH:12][cH:13][cH:14]2)[n:7]1)[O:27][C:25]([CH:24]([c:21]1[cH:20][cH:19][c:18]([Cl:17])[cH:23][cH:22]1)[CH:28]([CH3:29])[CH3:30])=[O:26]Participants
5
Sources & evidence
- ORD record
- ord-101fd60d02984011b8becb14a8ed6ad6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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