Toluene → 1,3-Dibenzyl-2-oxo-1,4,8-triazaspiro[4,5]decane-8-thiocarboxylic acid (2,4-difluorophenyl)amide
Reaction equation
[CH2:12]([c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1)[N:19]1[C:20](=[O:36])[CH:21]([CH2:29][c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[NH:22][C:23]12[CH2:24][CH2:25][NH:26][CH2:27][CH2:28]2.[CH3:37][c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1.[F:1][c:2]1[c:3]([N:9]=[C:10]=[S:11])[cH:4][cH:5][c:6]([F:8])[cH:7]1>>[F:1][c:2]1[c:3]([NH:9][C:10](=[S:11])[N:26]2[CH2:25][CH2:24][C:23]3([N:19]([CH2:12][c:13]4[cH:14][cH:15][cH:16][cH:17][cH:18]4)[C:20](=[O:36])[CH:21]([CH2:29][c:30]4[cH:31][cH:32][cH:33][cH:34][cH:35]4)[NH:22]3)[CH2:28][CH2:27]2)[cH:4][cH:5][c:6]([F:8])[cH:7]1Participants
4
Sources & evidence
- ORD record
- ord-136d387badf949f7b9d944eb275f17e3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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