Toluene → HCID 10187839, compound
Reaction equation
[CH3:26][O:27][C:28]([c:29]1[cH:30][c:31]([CH:43]([CH3:44])[CH3:45])[c:32]([O:38][S:39]([NH2:40])(=[O:41])=[O:42])[c:33]([CH:35]([CH3:36])[CH3:37])[cH:34]1)=[O:46].[CH3:47][CH2:48][N:49]([CH2:50][CH3:51])[CH2:52][CH3:53].[CH3:54][c:55]1[cH:56][cH:57][cH:58][cH:59][cH:60]1.[CH3:61][N:62]([CH3:63])[CH:64]=[O:65].[CH:7]([CH3:8])([CH3:9])[c:10]1[c:11]([CH2:22][C:23](=[O:24])[OH:25])[c:12]([CH:19]([CH3:20])[CH3:21])[cH:13][c:14]([CH:16]([CH3:17])[CH3:18])[cH:15]1.[Cl:1][C:2]([C:3]([Cl:4])=[O:5])=[O:6]>>[CH:7]([CH3:8])([CH3:9])[c:10]1[c:11]([CH2:22][C:23](=[O:24])[NH:40][S:39]([O:38][c:32]2[c:31]([CH:43]([CH3:44])[CH3:45])[cH:30][c:29]([C:28]([O:27][CH3:26])=[O:46])[cH:34][c:33]2[CH:35]([CH3:36])[CH3:37])(=[O:41])=[O:42])[c:12]([CH:19]([CH3:20])[CH3:21])[cH:13][c:14]([CH:16]([CH3:17])[CH3:18])[cH:15]1Participants
7
Sources & evidence
- ORD record
- ord-2c520a6d1e7943c183a6f7d32fdedd64
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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