Toluene → S-(3-benzylidene-1-tritylpiperidin-4-yl) ethanethioate
Reaction equation
[C:67]([CH3:68])(=[S:69])[OH:70].[CH3:76][c:77]1[cH:78][cH:79][cH:80][cH:81][cH:82]1.[CH:34]([c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1)=[C:41]1[CH2:42][N:43]([C:48]([c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)([c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)[c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)[CH2:44][CH2:45][CH:46]1[OH:47].[O:20]=[C:21]([O:22][CH:23]([CH3:24])[CH3:25])[N:26]=[N:27][C:28]([O:29][CH:30]([CH3:31])[CH3:32])=[O:33].[O:71]1[CH2:72][CH2:73][CH2:74][CH2:75]1.[c:1]1([P:2]([c:3]2[cH:4][cH:5][cH:6][cH:7][cH:8]2)[c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)[cH:15][cH:16][cH:17][cH:18][cH:19]1>>[CH:34]([c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1)=[C:41]1[CH2:42][N:43]([C:48]([c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)([c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)[c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)[CH2:44][CH2:45][CH:46]1[S:69][C:67]([CH3:68])=[O:70]Participants
7
Sources & evidence
- ORD record
- ord-f436a3ea7582478389f9e60e3b2ab958
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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