Dimethyl Sulfoxide → 1-(4-Methylphenyl)isoquinoline-5-acetonitrile
Reaction equation
[CH3:24][S:25]([CH3:26])=[O:27].[CH3:4][c:5]1[cH:6][cH:7][c:8](-[c:11]2[n:12][cH:13][cH:14][c:15]3[c:16]([CH2:21][Cl:22])[cH:17][cH:18][cH:19][c:20]23)[cH:9][cH:10]1.[Na:1][C:2]#[N:3].[OH2:23]>>[C:2](#[N:3])[CH2:21][c:16]1[c:15]2[cH:14][cH:13][n:12][c:11](-[c:8]3[cH:7][cH:6][c:5]([CH3:4])[cH:10][cH:9]3)[c:20]2[cH:19][cH:18][cH:17]1Participants
5
Sources & evidence
- ORD record
- ord-59e283e4abbd4aadaecff29c55100eb0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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