Ethanol → HCID 18007634, compound
Reaction equation
[CH3:42][CH2:43][OH:44].[CH:38]([OH:39])([CH3:40])[CH3:41].[Cl:1][c:2]1[cH:3][n:4][n:5][c:6]2[cH:7][c:8]([O:14][CH2:15][CH2:16][O:17][CH3:18])[c:9]([O:12][CH3:13])[cH:10][c:11]12.[K+:37].[OH-:36].[SH:19][CH2:20][c:21]1[cH:22][c:23]([C:24](=[O:25])[NH:26][c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[cH:33][cH:34][cH:35]1>>[c:2]1([S:19][CH2:20][c:21]2[cH:22][c:23]([C:24](=[O:25])[NH:26][c:27]3[cH:28][cH:29][cH:30][cH:31][cH:32]3)[cH:33][cH:34][cH:35]2)[cH:3][n:4][n:5][c:6]2[cH:7][c:8]([O:14][CH2:15][CH2:16][O:17][CH3:18])[c:9]([O:12][CH3:13])[cH:10][c:11]12Participants
7
Sources & evidence
- ORD record
- ord-01b9c514cfe24c708d9022b0ffd7823b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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