Ethyl Acetate → HCID 74438405, compound
Reaction equation
[CH3:24][CH2:25][O:26][C:27]([CH3:28])=[O:29].[OH:30][O:31][C:32]([c:33]1[cH:34][c:35]([Cl:36])[cH:37][cH:38][cH:39]1)=[O:40].[nH:1]1[n:2][cH:3][n:4][c:5]1[CH:6]([CH3:7])[c:8]1[cH:9][cH:10][c:11]([NH:14][c:15]2[s:16][cH:17][c:18]([C:20]([F:21])([F:22])[F:23])[n:19]2)[cH:12][cH:13]1>>[n:1]1([OH:26])[n:2][cH:3][n:4][c:5]1[CH:6]([CH3:7])[c:8]1[cH:9][cH:10][c:11]([NH:14][c:15]2[s:16][cH:17][c:18]([C:20]([F:21])([F:22])[F:23])[n:19]2)[cH:12][cH:13]1Participants
4
Sources & evidence
- ORD record
- ord-e46ae710894e4953a265b65e8242033b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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