Dimethyl Sulfoxide → 4-[(4-Bromo-butyl)-[1,2,4]triazol-4-yl-amino]-benzonitrile
Reaction equation
[Br:17][CH2:18][CH2:19][CH2:20][CH2:21][Br:22].[CH3:23][CH2:24][O:25][C:26](=[O:27])[CH3:28].[CH3:29][S:30]([CH3:31])=[O:32].[H-:1].[Na+:2].[n:3]1[n:4][cH:5][n:6]([NH:8][c:9]2[cH:10][cH:11][c:12]([C:13]#[N:14])[cH:15][cH:16]2)[cH:7]1>>[n:3]1[n:4][cH:5][n:6]([N:8]([c:9]2[cH:10][cH:11][c:12]([C:13]#[N:14])[cH:15][cH:16]2)[CH2:21][CH2:20][CH2:19][CH2:18][Br:17])[cH:7]1Participants
7
Sources & evidence
- ORD record
- ord-26831432b324460f8e43b493eb734df5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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