Toluene → N-methyl-2-[1-[2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetyl]piperidin-4-yl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-thiazole-4-carbothioamide
Reaction equation
[CH3:1][N:2]([C:3](=[O:4])[c:5]1[n:6][c:7]([CH:10]2[CH2:11][CH2:12][N:13]([C:16]([CH2:17][n:18]3[n:19][c:20]([C:24]([F:25])([F:26])[F:27])[cH:21][c:22]3[CH3:23])=[O:28])[CH2:14][CH2:15]2)[s:8][cH:9]1)[CH:29]1[CH2:30][CH2:31][CH2:32][c:33]2[cH:34][cH:35][cH:36][cH:37][c:38]21.[CH3:39][O:40][c:41]1[cH:42][cH:43][c:44]([P:45]2(=[S:46])[S:47][P:49](=[S:50])([c:51]3[cH:52][cH:53][c:54]([O:55][CH3:56])[cH:57][cH:58]3)[S:48]2)[cH:59][cH:60]1.[CH3:61][c:62]1[cH:63][cH:64][cH:65][cH:66][cH:67]1>>[CH3:1][N:2]([C:3]([c:5]1[n:6][c:7]([CH:10]2[CH2:11][CH2:12][N:13]([C:16]([CH2:17][n:18]3[n:19][c:20]([C:24]([F:25])([F:26])[F:27])[cH:21][c:22]3[CH3:23])=[O:28])[CH2:14][CH2:15]2)[s:8][cH:9]1)=[S:48])[CH:29]1[CH2:30][CH2:31][CH2:32][c:33]2[cH:34][cH:35][cH:36][cH:37][c:38]21Participants
4
Reactant 3
Product 1
Sources & evidence
- ORD record
- ord-66df1d1510964332bbb5c75d8fd2e3de
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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