1,2-Dichloroethane → Methyl 2-(2-propylpentanoylamino)pent-4-enoate
Reaction equation
[CH2:30]([Cl:31])[CH2:32][Cl:33].[CH3:20][CH2:21][CH2:22][CH:23]([CH2:24][CH2:25][CH3:26])[C:27]([OH:28])=[O:29].[CH:1]([N:2]([CH2:3][CH3:4])[CH:5]([CH3:6])[CH3:7])([CH3:8])[CH3:9].[ClH:10].[ClH:44].[NH2:11][CH:12]([C:13](=[O:14])[O:15][CH3:16])[CH2:17][CH:18]=[CH2:19].[O:45]=[CH:46][N:47]([CH3:48])[CH3:49].[OH:34][n:35]1[c:36]2[c:37]([cH:38][cH:39][cH:40][cH:41]2)[n:42][n:43]1>>[NH:11]([CH:12]([C:13](=[O:14])[O:15][CH3:16])[CH2:17][CH:18]=[CH2:19])[C:27]([CH:23]([CH2:22][CH2:21][CH3:20])[CH2:24][CH2:25][CH3:26])=[O:28]Participants
8
Sources & evidence
- ORD record
- ord-ac29f472d7a447d3b10b2e5cc73bc121
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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