Trifluoroacetic acid → 2-ethylthieno[2,3-b][1,5]benzoxazepin-4(5H)-one
Reaction equation
[C:1]([CH3:2])(=[O:3])[c:4]1[cH:5][c:6]2[c:7]([s:18]1)[O:8][c:9]1[c:10]([cH:14][cH:15][cH:16][cH:17]1)[NH:11][C:12]2=[O:13].[CH2:19]([SiH:20]([CH2:21][CH3:22])[CH2:23][CH3:24])[CH3:25].[OH:26][C:27]([C:28]([F:29])([F:30])[F:31])=[O:32]>>[CH2:1]([CH3:2])[c:4]1[cH:5][c:6]2[c:7]([s:18]1)[O:8][c:9]1[c:10]([cH:14][cH:15][cH:16][cH:17]1)[NH:11][C:12]2=[O:13]Participants
4
Sources & evidence
- ORD record
- ord-50aad0a8c86b43a2a2c2305e7571232d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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