1,4-Dioxane → HCID 178444873, compound
Reaction equation
[CH2:19]([CH2:20][CH2:21][CH2:22][CH2:23][CH3:24])[N:25]=[C:26]=[O:27].[NH2:1][c:2]1[n:3][nH:4][c:5]2[n:6][cH:7][n:8][c:9]([NH:11][c:12]3[cH:13][c:14]([Cl:18])[cH:15][cH:16][cH:17]3)[c:10]12.[O:28]1[CH2:29][CH2:30][O:31][CH2:32][CH2:33]1>>[NH:1]([c:2]1[n:3][nH:4][c:5]2[n:6][cH:7][n:8][c:9]([NH:11][c:12]3[cH:13][c:14]([Cl:18])[cH:15][cH:16][cH:17]3)[c:10]12)[C:26]([NH:25][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH3:24])=[O:27]Participants
4
Sources & evidence
- ORD record
- ord-25d88816bc8548f689e70bf7b48cf204
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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