Toluene → HCID 67040940, compound
Reaction equation
[CH3:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1.[Cl:1][C:2]([CH2:3][O:4][C:5]([NH:6][c:7]1[cH:8][cH:9][c:10]([S:13][c:14]2[c:15]([N+:23](=[O:24])[O-:25])[cH:16][c:17]([C:20](=[O:21])[Cl:22])[cH:18][cH:19]2)[cH:11][cH:12]1)=[O:26])([Cl:27])[Cl:28].[s:29]1[c:30]([NH2:34])[n:31][n:32][cH:33]1>>[Cl:1][C:2]([CH2:3][O:4][C:5]([NH:6][c:7]1[cH:8][cH:9][c:10]([S:13][c:14]2[c:15]([N+:23](=[O:24])[O-:25])[cH:16][c:17]([C:20](=[O:21])[NH:34][c:30]3[s:29][cH:33][n:32][n:31]3)[cH:18][cH:19]2)[cH:11][cH:12]1)=[O:26])([Cl:27])[Cl:28]Participants
4
Sources & evidence
- ORD record
- ord-05390d61077d455f8c759dab5bd1c754
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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