Ethyl Acetate → HCID 178452232, compound
Reaction equation
[CH3:41][S:42]([Cl:43])(=[O:44])=[O:45].[CH3:46][CH2:47][O:48][C:49]([CH3:50])=[O:51].[CH:32]([N:33]([CH2:34][CH3:35])[CH:36]([CH3:37])[CH3:38])([CH3:39])[CH3:40].[OH:1][CH2:2][CH:3]1[CH2:4][N:5]([C:25](=[O:26])[O:27][C:28]([CH3:29])([CH3:30])[CH3:31])[CH2:6][CH2:7][N:8]1[c:9]1[cH:10][cH:11][c:12]([C:15]([C:16]([F:17])([F:18])[F:19])([C:20]([F:21])([F:22])[F:23])[OH:24])[cH:13][cH:14]1>>[O:1]([CH2:2][CH:3]1[CH2:4][N:5]([C:25](=[O:26])[O:27][C:28]([CH3:29])([CH3:30])[CH3:31])[CH2:6][CH2:7][N:8]1[c:9]1[cH:10][cH:11][c:12]([C:15]([C:16]([F:17])([F:18])[F:19])([C:20]([F:21])([F:22])[F:23])[OH:24])[cH:13][cH:14]1)[S:42]([CH3:41])(=[O:44])=[O:45]Participants
5
Sources & evidence
- ORD record
- ord-120788ec814f4606b0f1b52b7de6068d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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