Ethanol → 3-{2-[4-(4-Chlorophenoxy)-phenyl]-ethylamino}-4-(pyridin-3-yl-amino)-cyclobut-3-ene-1,2-dione
Reaction equation
[CH2:1]([O:2][c:4]1[c:5](=[O:16])[c:6](=[O:15])[c:7]1[NH:8][c:9]1[cH:10][n:11][cH:12][cH:13][cH:14]1)[CH3:3].[CH3:34][CH2:35][OH:36].[Cl:17][c:18]1[cH:19][cH:20][c:21]([O:22][c:23]2[cH:24][cH:25][c:26]([CH2:29][CH2:30][NH2:31])[cH:27][cH:28]2)[cH:32][cH:33]1>>[c:4]1([NH:31][CH2:30][CH2:29][c:26]2[cH:25][cH:24][c:23]([O:22][c:21]3[cH:20][cH:19][c:18]([Cl:17])[cH:33][cH:32]3)[cH:28][cH:27]2)[c:5](=[O:16])[c:6](=[O:15])[c:7]1[NH:8][c:9]1[cH:10][n:11][cH:12][cH:13][cH:14]1Participants
4
Sources & evidence
- ORD record
- ord-4d6a56aebfd945459a1207e206dfaa81
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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