Bicarbonate Ion → 3-Acetyl-7-methylsulfonyl-2,3,4,5-tetrahydro-1H-3-benzazepine
Reaction equation
[C:12]([CH3:13])(=[O:14])[N:15]1[CH2:16][CH2:17][c:18]2[c:19]([cH:22][cH:23][c:24]([S:26](=[O:27])(=[O:28])[Cl:29])[cH:25]2)[CH2:20][CH2:21]1.[C:7](=[O:8])([O-:9])[OH:10].[CH3:30][I:31].[Na+:11].[Na+:5].[Na+:6].[O:33]1[CH2:34][CH2:35][CH2:36][CH2:37]1.[OH2:32].[S:1]([O-:2])([O-:3])=[O:4]>>[CH3:7][S:26]([c:24]1[cH:23][cH:22][c:19]2[c:18]([cH:25]1)[CH2:17][CH2:16][N:15]([C:12]([CH3:13])=[O:14])[CH2:21][CH2:20]2)(=[O:27])=[O:28]Participants
8
Sources & evidence
- ORD record
- ord-761c19f1bbc24d5ba4dfcdaf71a3ac93
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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