Benzene → 3-chloromethyl-2,3-dihydro-2-phenyl-1,5-benzothiazepin-4(5H)-one
Reaction equation
[OH:1][CH2:2][CH:3]1[CH:4]([c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[S:5][c:6]2[c:7]([cH:11][cH:12][cH:13][cH:14]2)[NH:8][C:9]1=[O:10].[S:27]([Cl:28])([Cl:29])=[O:30].[cH:21]1[cH:22][cH:23][n:24][cH:25][cH:26]1.[cH:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1>>[CH2:2]([CH:3]1[CH:4]([c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[S:5][c:6]2[c:7]([cH:11][cH:12][cH:13][cH:14]2)[NH:8][C:9]1=[O:10])[Cl:29]Participants
5
Sources & evidence
- ORD record
- ord-b6c8c201fe7a4b8490940fb2559a72ae
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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