Acetone → 6-(3,7-Dimethylocta-2,6-dienoxy)-1,3-benzothiazole-2-carbonitrile
Reaction equation
[C:34]([O:35][CH2:36][CH3:37])(=[O:38])[CH3:39].[C:5](=[O:6])([O-:7])[O-:8].[CH2:11]([CH:12]=[C:13]([CH3:14])[CH2:15][CH2:16][CH:17]=[C:18]([CH3:19])[CH3:20])[Br:21].[CH3:1][C:2](=[O:3])[CH3:4].[CH3:40][CH2:41][CH2:42][CH2:43][CH2:44][CH2:45][CH3:46].[K+:10].[K+:9].[OH:22][c:23]1[cH:24][c:25]2[c:26]([n:27][c:28]([C:30]#[N:31])[s:29]2)[cH:32][cH:33]1>>[CH2:11]([CH:12]=[C:13]([CH3:14])[CH2:15][CH2:16][CH:17]=[C:18]([CH3:19])[CH3:20])[O:22][c:23]1[cH:24][c:25]2[c:26]([n:27][c:28]([C:30]#[N:31])[s:29]2)[cH:32][cH:33]1Participants
8
Sources & evidence
- ORD record
- ord-c6192aead6ae4b2695eb2a5baf064a19
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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