Acetic Acid → N-(1-Benzyl-8-chloro-6-cyano-1,2,3,4-tetrahydroquinolin-3-yl)-benzenesulfonamide
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH:10]([NH:20][S:21](=[O:22])(=[O:23])[c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)[CH2:11][c:12]2[cH:13][c:14]([C:18]#[N:19])[cH:15][cH:16][c:17]21.[CH2:46]([N+:47]([CH3:48])([CH3:49])[CH3:50])[c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1.[CH3:57][C:58](=[O:59])[OH:60].[I:30](=[O:31])(=[O:32])[Cl:33].[I:34]([Cl:35])(=[O:36])=[O:37].[I:38]([Cl:39])(=[O:40])=[O:41].[I:42]([Cl:43])(=[O:44])=[O:45]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH:10]([NH:20][S:21](=[O:22])(=[O:23])[c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)[CH2:11][c:12]2[cH:13][c:14]([C:18]#[N:19])[cH:15][c:16]([Cl:33])[c:17]21Participants
5
Sources & evidence
- ORD record
- ord-812e622066d442939a22110a1c45ff9d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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