Benzene → HCID 178469019, compound
Reaction equation
[Br:1][CH2:2][CH:3]1[S:4][c:5]2[c:6]([cH:14][cH:15][cH:16][cH:17]2)[O:7][c:8]2[c:9]1[cH:10][cH:11][cH:12][cH:13]2.[C:18]([CH:19]([CH:20]([C:21]([OH:22])=[O:23])[OH:24])[OH:25])([OH:26])=[O:27].[CH2:28]([CH3:29])[O:30][C:31](=[O:32])[CH:33]1[CH2:34][NH:35][CH2:36][CH2:37][CH2:38]1.[CH:39]([Cl:40])([Cl:41])[Cl:42].[cH:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1>>[CH2:2]([CH:3]1[S:4][c:5]2[c:6]([cH:14][cH:15][cH:16][cH:17]2)[O:7][c:8]2[c:9]1[cH:10][cH:11][cH:12][cH:13]2)[N:35]1[CH2:34][CH:33]([C:31]([O:30][CH2:28][CH3:29])=[O:32])[CH2:38][CH2:37][CH2:36]1Participants
6
Sources & evidence
- ORD record
- ord-b1191a83574e43a99d765817a2b27d60
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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