Bromide ion → 4-[2-[4-[2-(2,2-Dimethyl-1,3-benzodithiol-5-yl)prop-1-enyl]phenoxy]ethyl]morpholine
Reaction equation
[Br-:1].[CH2:34]([Li:35])[CH2:36][CH2:37][CH3:38].[CH3:2][C:3]1([CH3:33])[S:4][c:5]2[c:6]([cH:8][cH:9][c:10]([CH:12]([CH3:13])[P+:14]([c:15]3[cH:16][cH:17][cH:18][cH:19][cH:20]3)([c:21]3[cH:22][cH:23][cH:24][cH:25][cH:26]3)[c:27]3[cH:28][cH:29][cH:30][cH:31][cH:32]3)[cH:11]2)[S:7]1.[CH3:61][CH2:62][CH2:63][CH2:64][CH2:65][CH3:66].[O:39]1[CH2:40][CH2:41][N:42]([CH2:45][CH2:46][O:47][c:48]2[cH:49][cH:50][c:51]([CH:52]=[O:53])[cH:54][cH:55]2)[CH2:43][CH2:44]1.[O:56]1[CH2:57][CH2:58][CH2:59][CH2:60]1>>[CH3:2][C:3]1([CH3:33])[S:4][c:5]2[c:6]([cH:8][cH:9][c:10]([C:12]([CH3:13])=[CH:52][c:51]3[cH:50][cH:49][c:48]([O:47][CH2:46][CH2:45][N:42]4[CH2:41][CH2:40][O:39][CH2:44][CH2:43]4)[cH:55][cH:54]3)[cH:11]2)[S:7]1Participants
7
Sources & evidence
- ORD record
- ord-c9104451fbf84e0f92e813c294d706de
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
Loading…