Sodium ion → 3-(cis-4-[3-(3-Fluoro-phenoxy)-azetidin-1-yl]-cyclohexyl)-1H-indole-5-carbonitrile
Reaction equation
[C:31]([O:32][BH-:33]([O:34][C:35](=[O:36])[CH3:37])[O:38][C:39](=[O:40])[CH3:41])(=[O:42])[CH3:43].[Cl:45][CH2:46][Cl:47].[F:1][c:2]1[cH:3][c:4]([O:5][CH:6]2[CH2:7][NH:8][CH2:9]2)[cH:10][cH:11][cH:12]1.[Na+:44].[O:13]=[C:14]1[CH2:15][CH2:16][CH:17]([c:20]2[cH:21][nH:22][c:23]3[cH:24][cH:25][c:26]([C:29]#[N:30])[cH:27][c:28]23)[CH2:18][CH2:19]1>>[F:1][c:2]1[cH:3][c:4]([O:5][CH:6]2[CH2:7][N:8]([CH:14]3[CH2:15][CH2:16][CH:17]([c:20]4[cH:21][nH:22][c:23]5[cH:24][cH:25][c:26]([C:29]#[N:30])[cH:27][c:28]45)[CH2:18][CH2:19]3)[CH2:9]2)[cH:10][cH:11][cH:12]1Participants
6
Sources & evidence
- ORD record
- ord-b6abf49e3c46485cb73a44d69d63519a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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