Iodoethane → 7-Chloro-3-ethyl-1,3,4,5-tetrahydro-3-(methoxycarbonyl)-4-(4-methoxyphenyl)-2H-1-benzazepin-2-one
Reaction equation
[CH2:9]([Li:10])[CH2:11][CH2:12][CH3:13].[CH3:54][CH2:55][CH2:56][CH2:57][CH2:58][CH3:59].[CH3:60][N:61]([CH3:62])[P:63](=[O:64])([N:65]([CH3:66])[CH3:67])[N:68]([CH3:69])[CH3:70].[CH:14]([NH:15][CH:16]([CH3:17])[CH3:18])([CH3:19])[CH3:20].[CH:1]([CH3:2])([N-:3][CH:4]([CH3:5])[CH3:6])[CH3:7].[Cl:21][c:22]1[cH:23][cH:24][c:25]2[c:26]([cH:45]1)[CH2:27][CH:28]([c:37]1[cH:38][cH:39][c:40]([O:43][CH3:44])[cH:41][cH:42]1)[CH:29]([C:33](=[O:34])[O:35][CH3:36])[C:30](=[O:32])[NH:31]2.[I:46][CH2:47][CH3:48].[Li+:8].[O:49]1[CH2:50][CH2:51][CH2:52][CH2:53]1>>[CH2:1]([CH3:2])[C:29]1([C:33](=[O:34])[O:35][CH3:36])[CH:28]([c:37]2[cH:38][cH:39][c:40]([O:43][CH3:44])[cH:41][cH:42]2)[CH2:27][c:26]2[c:25]([cH:24][cH:23][c:22]([Cl:21])[cH:45]2)[NH:31][C:30]1=[O:32]Participants
10
Reactant 9
Product 1
Sources & evidence
- ORD record
- ord-1835662c51df4afca6d0a77c44a7015b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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