Toluene → HCID 10181892, compound
Reaction equation
[CH3:1][N:2]([c:3]1[cH:4][cH:5][c:6]([CH2:9][N:10]([C:11](=[O:12])[CH:13]2[CH2:14][CH2:15][CH2:16][c:17]3[cH:18][cH:19][cH:20][cH:21][c:22]32)[c:23]2[cH:24][cH:25][c:26]([CH:29]([CH3:30])[CH3:31])[cH:27][cH:28]2)[cH:7][cH:8]1)[CH3:32].[CH3:33][O:34][c:35]1[cH:36][cH:37][c:38]([P:39]2(=[S:42])[S:40][P:41]([c:43]3[cH:44][cH:45][c:46]([O:47][CH3:48])[cH:49][cH:50]3)(=[S:51])[S:52]2)[cH:53][cH:54]1.[CH3:55][c:56]1[cH:57][cH:58][cH:59][cH:60][cH:61]1>>[CH3:1][N:2]([c:3]1[cH:4][cH:5][c:6]([CH2:9][N:10]([C:11]([CH:13]2[CH2:14][CH2:15][CH2:16][c:17]3[cH:18][cH:19][cH:20][cH:21][c:22]32)=[S:42])[c:23]2[cH:24][cH:25][c:26]([CH:29]([CH3:30])[CH3:31])[cH:27][cH:28]2)[cH:7][cH:8]1)[CH3:32]Participants
4
Sources & evidence
- ORD record
- ord-f253381d174c477ca7a030baf6fa253c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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