Toluene → HCID 86659538, compound
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[c:9]([NH:22][C:23]([CH2:24][c:25]2[cH:26][cH:27][c:28]([O:31][CH3:32])[cH:29][cH:30]2)=[O:33])[n:10][cH:11][c:12](-[c:14]2[cH:15][cH:16][c:17]([O:20][CH3:21])[cH:18][cH:19]2)[n:13]1.[CH3:34][O:35][c:36]1[cH:37][cH:38][c:39]([P:40]2(=[S:43])[S:41][P:42]([c:44]3[cH:45][cH:46][c:47]([O:48][CH3:49])[cH:50][cH:51]3)(=[S:52])[S:53]2)[cH:54][cH:55]1.[CH3:56][c:57]1[cH:58][cH:59][cH:60][cH:61][cH:62]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[c:9]([NH:22][C:23]([CH2:24][c:25]2[cH:26][cH:27][c:28]([O:31][CH3:32])[cH:29][cH:30]2)=[S:43])[n:10][cH:11][c:12](-[c:14]2[cH:15][cH:16][c:17]([O:20][CH3:21])[cH:18][cH:19]2)[n:13]1Participants
4
Sources & evidence
- ORD record
- ord-d428f25a38574a728a7f559ccc7e3aa9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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