Chloroacetyl chloride → HCID 72404155, compound
Reaction equation
[CH:47]([N:48]([CH2:49][CH3:50])[CH:51]([CH3:52])[CH3:53])([CH3:54])[CH3:55].[Cl:42][CH2:43][C:44](=[O:45])[Cl:46].[F:1][c:2]1[cH:3][c:4]([C:8]2([CH2:22][CH2:23][N:24]3[CH:25]4[CH2:26][CH:27]([n:32]5[c:33]([CH3:41])[n:34][c:35]6[c:36]5[cH:37][cH:38][cH:39][cH:40]6)[CH2:28][CH:29]3[CH2:30][CH2:31]4)[CH2:9][CH2:10][N:11]([C:14]([C:15]([CH:16]([CH3:17])[CH3:18])([NH2:19])[CH3:20])=[O:21])[CH2:12][CH2:13]2)[cH:5][cH:6][cH:7]1>>[F:1][c:2]1[cH:3][c:4]([C:8]2([CH2:22][CH2:23][N:24]3[CH:25]4[CH2:26][CH:27]([n:32]5[c:33]([CH3:41])[n:34][c:35]6[c:36]5[cH:37][cH:38][cH:39][cH:40]6)[CH2:28][CH:29]3[CH2:30][CH2:31]4)[CH2:9][CH2:10][N:11]([C:14]([C:15]([CH:16]([CH3:17])[CH3:18])([NH:19][C:44]([CH2:43][Cl:42])=[O:45])[CH3:20])=[O:21])[CH2:12][CH2:13]2)[cH:5][cH:6][cH:7]1Participants
4
Sources & evidence
- ORD record
- ord-b0837522e3ff466d93b7b6c40a94be47
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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