Imidazole → alpha-(3,4-Dimethoxyphenyl)-1,3-dihydro-5-[2-(1H-imidazol-1-yl)ethoxy]-6-methoxy-alpha-[(4-methylphenyl)-thio]-2H-isoindole-2-heptanenitrile
Reaction equation
[CH3:51][N:52]([CH3:53])[CH:54]=[O:55].[CH3:56][c:57]1[cH:58][cH:59][cH:60][cH:61][cH:62]1.[Cl:8][CH2:9][CH2:10][O:11][c:12]1[cH:13][c:14]2[c:18]([cH:19][c:20]1[O:21][CH3:22])[CH2:17][N:16]([CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][C:28]([C:29]#[N:30])([S:31][c:32]1[cH:33][cH:34][c:35]([CH3:38])[cH:36][cH:37]1)[c:39]1[cH:40][c:41]([O:47][CH3:48])[c:42]([O:45][CH3:46])[cH:43][cH:44]1)[CH2:15]2.[H-:6].[I-:50].[Na+:49].[Na+:7].[OH2:63].[nH:1]1[cH:2][n:3][cH:4][cH:5]1>>[n:1]1([CH2:9][CH2:10][O:11][c:12]2[cH:13][c:14]3[c:18]([cH:19][c:20]2[O:21][CH3:22])[CH2:17][N:16]([CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][C:28]([C:29]#[N:30])([S:31][c:32]2[cH:33][cH:34][c:35]([CH3:38])[cH:36][cH:37]2)[c:39]2[cH:40][c:41]([O:47][CH3:48])[c:42]([O:45][CH3:46])[cH:43][cH:44]2)[CH2:15]3)[cH:2][n:3][cH:4][cH:5]1Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-24a76ab7f72948709ab75a94f55da921
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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