Bicarbonate Ion → 2,3,4,5-tetrahydro-1-benzothiepine 1,1-dioxide
Reaction equation
[CH2:35]([Cl:36])[Cl:37].[Cl:13][c:14]1[cH:15][c:16]([C:21](=[O:18])[O:22][OH:23])[cH:17][cH:19][cH:20]1.[Na+:28].[Na+:29].[Na+:34].[O-:30][C:31]([OH:32])=[O:33].[S:1]1(=[O:12])[CH2:2][CH2:3][CH2:4][CH2:5][c:6]2[c:7]1[cH:8][cH:9][cH:10][cH:11]2.[S:24]([O-:25])([O-:26])=[O:27]>>[S:1]1(=[O:12])(=[O:18])[CH2:2][CH2:3][CH2:4][CH2:5][c:6]2[c:7]1[cH:8][cH:9][cH:10][cH:11]2Participants
7
Sources & evidence
- ORD record
- ord-05a3d29145cf4639aac56386d77d4d76
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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