Sodium ion → [2-(3,4-Dichloro-phenoxy)-5-(4-isopropyl-2-oxo-piperazin-1-ylmethyl)-benzyl]-methyl-carbamic acid tert-butyl ester
Reaction equation
[C:13]([CH3:14])([CH3:15])([CH3:16])[O:17][C:18]([N:19]([CH3:20])[CH2:21][c:22]1[c:23]([O:30][c:31]2[cH:32][c:33]([Cl:38])[c:34]([Cl:37])[cH:35][cH:36]2)[cH:24][cH:25][c:26]([CH2:28][Cl:29])[cH:27]1)=[O:39].[CH:1]([CH3:2])([CH3:3])[N:4]1[CH2:5][C:6](=[O:10])[NH:7][CH2:8][CH2:9]1.[H-:12].[Na+:11].[O:40]=[CH:41][N:42]([CH3:43])[CH3:44]>>[CH:1]([CH3:2])([CH3:3])[N:4]1[CH2:5][C:6](=[O:10])[N:7]([CH2:28][c:26]2[cH:25][cH:24][c:23]([O:30][c:31]3[cH:32][c:33]([Cl:38])[c:34]([Cl:37])[cH:35][cH:36]3)[c:22]([CH2:21][N:19]([C:18]([O:17][C:13]([CH3:14])([CH3:15])[CH3:16])=[O:39])[CH3:20])[cH:27]2)[CH2:8][CH2:9]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-df7354eeb6504b34a4d1bffe01363943
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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