Dimethyl Sulfoxide → 1-(4-Bromophenyl)isoquinoline-5-acetonitrile
Reaction equation
[Br:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[n:16][cH:17][cH:18][c:19]3[c:20]([CH2:25][Cl:26])[cH:21][cH:22][cH:23][c:24]23)[cH:13][cH:14]1.[C:27](=[O:28])([OH:29])[O-:30].[CH3:32][CH2:33][O:34][C:35](=[O:36])[CH3:37].[CH3:4][S:5]([CH3:6])=[O:7].[Na+:31].[Na:1][C:2]#[N:3]>>[C:2](#[N:3])[CH2:25][c:20]1[c:19]2[cH:18][cH:17][n:16][c:15](-[c:12]3[cH:11][cH:10][c:9]([Br:8])[cH:14][cH:13]3)[c:24]2[cH:23][cH:22][cH:21]1Participants
7
Sources & evidence
- ORD record
- ord-05fdd682dbb24096ab122c032861b812
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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