Chloride → HCID 59129283, compound
Reaction equation
[CH3:21][CH2:22][N:23]([CH2:24][CH3:25])[CH2:26][CH3:27].[Cl-:20].[Cl:45][CH2:46][Cl:47].[NH2:28][c:29]1[cH:30][c:31]2[cH:32][c:33]([C:38]([CH2:39][CH2:40][C:41]#[N:42])([CH3:43])[CH3:44])[nH:34][c:35]2[cH:36][cH:37]1.[O:1]1[CH2:2][O:3][c:4]2[c:5]1[cH:6][cH:7][c:8]([C:10]1([C:13](=[O:14])[OH:15])[CH2:11][CH2:12]1)[cH:9]2.[O:48]=[CH:49][N:50]([CH3:51])[CH3:52].[S:16]([Cl:17])([Cl:18])=[O:19]>>[O:1]1[CH2:2][O:3][c:4]2[c:5]1[cH:6][cH:7][c:8]([C:10]1([C:13](=[O:15])[NH:28][c:29]3[cH:30][c:31]4[cH:32][c:33]([C:38]([CH2:39][CH2:40][C:41]#[N:42])([CH3:43])[CH3:44])[nH:34][c:35]4[cH:36][cH:37]3)[CH2:11][CH2:12]1)[cH:9]2Participants
8
Sources & evidence
- ORD record
- ord-c12724420b9343d68adeb7649094b3f3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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