Hydrogen Bromide → 3-Phenyl-2-[4-[3-(1-pyrrolidinyl)propoxy]phenyl]-1,4-benzoxathiin
Reaction equation
[Br:8][CH2:9][CH2:10][CH2:11][N:12]1[CH2:13][CH2:14][CH2:15][CH2:16][CH2:17]1.[BrH:7].[C:1](=[O:2])([O-:3])[O-:4].[CH3:46][CH2:47][O:48][C:49](=[O:50])[CH3:51].[K+:5].[K+:6].[O:18]=[CH:19][N:20]([CH3:21])[CH3:22].[c:23]1([C:29]2=[C:30]([c:39]3[cH:40][cH:41][c:42]([OH:45])[cH:43][cH:44]3)[O:31][c:32]3[c:33]([cH:35][cH:36][cH:37][cH:38]3)[S:34]2)[cH:24][cH:25][cH:26][cH:27][cH:28]1>>[CH2:10]1[CH2:11][N:12]([CH2:17][CH2:16][CH2:15][O:45][c:42]2[cH:41][cH:40][c:39]([C:30]3=[C:29]([c:23]4[cH:24][cH:25][cH:26][cH:27][cH:28]4)[S:34][c:33]4[c:32]([cH:38][cH:37][cH:36][cH:35]4)[O:31]3)[cH:44][cH:43]2)[CH2:13][CH2:14]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-f87741642af24478bcc86632830b8413
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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