Reaction equation
[C:1]([CH3:2])(=[O:3])[N:4]1[CH2:5][c:6]2[c:7]([c:10]([CH3:16])[c:11]([CH2:13][CH2:14][Cl:15])[s:12]2)[CH2:8][CH2:9]1.[ClH:17].[F:18][c:19]1[cH:20][cH:21][c:22]2[c:23]([s:24][cH:25][c:26]2[CH:27]2[CH2:28][CH2:29][NH:30][CH2:31][CH2:32]2)[cH:33]1>>[C:1]([CH3:2])(=[O:3])[N:4]1[CH2:5][c:6]2[c:7]([c:10]([CH3:16])[c:11]([CH2:13][CH2:14][N:30]3[CH2:29][CH2:28][CH:27]([c:26]4[c:22]5[cH:21][cH:20][c:19]([F:18])[cH:33][c:23]5[s:24][cH:25]4)[CH2:32][CH2:31]3)[s:12]2)[CH2:8][CH2:9]1Participants
4
Sources & evidence
- ORD record
- ord-47a700d838134fd09da2cd1f8382d95e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Linked notes
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