Dimethyl Sulfoxide → 7-[{4-[(4-butylphenyl)ethynyl]benzyl}(hexyl)amino]-2,2-dimethyl-4H-1,3-benzodioxin-4-one
Reaction equation
[Br:36][CH2:37][CH2:38][CH2:39][CH2:40][CH2:41][CH3:42].[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[cH:6][cH:7][c:8]([C:11]#[C:12][c:13]2[cH:14][cH:15][c:16]([CH2:17][NH:18][c:19]3[cH:20][c:21]4[c:22]([cH:30][cH:31]3)[C:23](=[O:29])[O:24][C:25]([CH3:27])([CH3:28])[O:26]4)[cH:32][cH:33]2)[cH:9][cH:10]1.[CH3:43][S:44]([CH3:45])=[O:46].[CH3:47][CH2:48][O:49][C:50]([CH3:51])=[O:52].[H-:34].[Na+:35]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[cH:6][cH:7][c:8]([C:11]#[C:12][c:13]2[cH:14][cH:15][c:16]([CH2:17][N:18]([c:19]3[cH:20][c:21]4[c:22]([cH:30][cH:31]3)[C:23](=[O:29])[O:24][C:25]([CH3:27])([CH3:28])[O:26]4)[CH2:37][CH2:38][CH2:39][CH2:40][CH2:41][CH3:42])[cH:32][cH:33]2)[cH:9][cH:10]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-4aff1a00a9074d1c9709297c8c191dfd
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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