Dimethylamine → {5-[3-(4-Bromo-phenyl)-benzo[d]isothiazol-6-yl]-pent-4-ynyl}-dimethyl-amine
Reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][s:10][c:11]3[c:12]2[cH:13][cH:14][c:15]([C:17]#[C:18][CH2:19][CH2:20][CH2:21][O:22][S:23]([CH3:24])(=[O:25])=[O:26])[cH:16]3)[cH:6][cH:7]1.[CH3:27][NH:28][CH3:29]>>[Br:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][s:10][c:11]3[c:12]2[cH:13][cH:14][c:15]([C:17]#[C:18][CH2:19][CH2:20][CH2:21][N:28]([CH3:27])[CH3:29])[cH:16]3)[cH:6][cH:7]1Participants
3
Sources & evidence
- ORD record
- ord-ce86bf474f514586932826f9a9d95e0a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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