1,4-Dioxane → HCID 57710290, compound
Reaction equation
[CH3:1][NH:2][c:3]1[cH:4][c:5]([NH:9][c:10]2[cH:11][c:12]([C:13]#[N:14])[cH:15][cH:16][cH:17]2)[n:6][cH:7][n:8]1.[Cl:18][c:19]1[c:20]([N:26]=[C:27]=[O:28])[c:21]([Cl:25])[cH:22][cH:23][cH:24]1.[O:29]1[CH2:30][CH2:31][O:32][CH2:33][CH2:34]1>>[CH3:1][N:2]([c:3]1[cH:4][c:5]([NH:9][c:10]2[cH:11][c:12]([C:13]#[N:14])[cH:15][cH:16][cH:17]2)[n:6][cH:7][n:8]1)[C:27]([NH:26][c:20]1[c:19]([Cl:18])[cH:24][cH:23][cH:22][c:21]1[Cl:25])=[O:28]Participants
4
Sources & evidence
- ORD record
- ord-be00fd94e76a45d7b1d85380097b470b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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