Benzene → HCID 4457426, compound
Reaction equation
[CH2:17]1[CH2:18][CH2:19][NH:20][CH2:21][CH2:22]1.[CH3:1][C:2](=[O:3])[CH2:4][C:5]([NH2:6])=[O:7].[Cl:8][c:9]1[cH:10][c:11]([CH:12]=[O:13])[cH:14][cH:15][cH:16]1.[c:23]1([CH3:24])[cH:25][cH:26][c:27]([S:28]([OH:29])(=[O:30])=[O:31])[cH:32][cH:33]1.[cH:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1>>[CH3:1][C:2](=[O:3])[C:4]([C:5]([NH2:6])=[O:7])=[CH:12][c:11]1[cH:10][c:9]([Cl:8])[cH:16][cH:15][cH:14]1Participants
6
Sources & evidence
- ORD record
- ord-621b107c17d14ccbbe2d8232aafa43bb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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