1,4-Dioxane → N-[(2,4-dichloro-3-isothiocyanatophenyl)methyl]-2,2-dimethylpropanamide
Reaction equation
[C:1](=[S:2])([n:3]1[cH:4][cH:5][cH:6][cH:7][c:8]1=[O:9])[n:10]1[cH:11][cH:12][cH:13][cH:14][c:15]1=[O:16].[NH2:17][c:18]1[c:19]([Cl:33])[c:20]([CH2:21][NH:22][C:23]([C:24]([CH3:25])([CH3:26])[CH3:27])=[O:28])[cH:29][cH:30][c:31]1[Cl:32].[O:34]1[CH2:35][CH2:36][O:37][CH2:38][CH2:39]1>>[C:1](=[S:2])=[N:17][c:18]1[c:19]([Cl:33])[c:20]([CH2:21][NH:22][C:23]([C:24]([CH3:25])([CH3:26])[CH3:27])=[O:28])[cH:29][cH:30][c:31]1[Cl:32]Participants
4
Sources & evidence
- ORD record
- ord-61c1b00d732b4bf5a7f06c0b017305f7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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