HCID 13460556, compound → HCID 59657672, compound
Reaction equation
[CH3:27][c:28]1[n:29][o:30][c:31]([CH2:33][O:34][S:35]([CH3:36])(=[O:37])=[O:38])[cH:32]1.[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([C:11](=[O:12])[N:13]3[CH2:14][CH2:15][C:16]4([O:17][CH2:18][c:19]5[c:20]4[cH:21][cH:22][cH:23][cH:24]5)[CH2:25][CH2:26]3)[cH:7][nH:8][c:9]2[cH:10]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([C:11](=[O:12])[N:13]3[CH2:14][CH2:15][C:16]4([O:17][CH2:18][c:19]5[c:20]4[cH:21][cH:22][cH:23][cH:24]5)[CH2:25][CH2:26]3)[cH:7][n:8]([CH2:33][c:31]3[o:30][n:29][c:28]([CH3:27])[cH:32]3)[c:9]2[cH:10]1Participants
3
Sources & evidence
- ORD record
- ord-adaa9a056aea43a7884f87a951b6799a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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