HCID 59855195, compound → HCID 69089101, compound
Reaction equation
[Br:1][c:2]1[cH:3][c:4]2[c:5]([n:6](-[c:9]3[cH:10][c:11]([OH:18])[c:12]([C:14](=[O:15])[O:16][CH3:17])[s:13]3)[cH:7][n:8]2)[cH:19][cH:20]1.[Cl:21][c:22]1[c:23]([O:31][CH:32]2[CH2:33][CH2:34][N:35]([C:38](=[O:39])[O:40][C:41]([CH3:42])([CH3:43])[CH3:44])[CH2:36][CH2:37]2)[cH:24][cH:25][cH:26][c:27]1[CH:28]([CH3:29])[OH:30]>>[Br:1][c:2]1[cH:3][c:4]2[c:5]([n:6](-[c:9]3[cH:10][c:11]([O:18][CH:28]([c:27]4[c:22]([Cl:21])[c:23]([O:31][CH:32]5[CH2:33][CH2:34][N:35]([C:38](=[O:39])[O:40][C:41]([CH3:42])([CH3:43])[CH3:44])[CH2:36][CH2:37]5)[cH:24][cH:25][cH:26]4)[CH3:29])[c:12]([C:14](=[O:15])[O:16][CH3:17])[s:13]3)[cH:7][n:8]2)[cH:19][cH:20]1Participants
3
Sources & evidence
- ORD record
- ord-d4037528748147c794658b0ee4577729
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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