Ethanol → 4-Chloro-7-(1-ethylpropyl)-1-methyl-1,3-dihydro-2H-benzimidazol-2-one
Reaction equation
[C:44]([Cl:45])([Cl:46])([Cl:47])[Cl:48].[CH2:13]([CH3:14])[CH:15]([CH2:16][CH3:17])[c:18]1[cH:19][cH:20][cH:21][c:22]2[c:23]1[n:24]([CH3:28])[c:25](=[O:27])[nH:26]2.[CH2:41]([OH:42])[CH3:43].[CH:37]([OH:38])([CH3:39])[CH3:40].[Cl:29][N:30]1[C:31](=[O:32])[CH2:33][CH2:34][C:35]1=[O:36].[N:1]([C:2]([CH3:3])([CH3:4])[C:5]#[N:6])=[N:7][C:8]([CH3:9])([CH3:10])[C:11]#[N:12]>>[CH2:13]([CH3:14])[CH:15]([CH2:16][CH3:17])[c:18]1[cH:19][cH:20][c:21]([Cl:29])[c:22]2[c:23]1[n:24]([CH3:28])[c:25](=[O:27])[nH:26]2Participants
7
Sources & evidence
- ORD record
- ord-7ea8589e9310439dbe1fde271a763354
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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