Chloride → HCID 9953170, compound
Reaction equation
[CH2:37]1[O:38][CH2:39][CH2:40][CH2:41]1.[CH3:34][C:35]#[N:36].[Cl-:26].[N:27]([O:28][C:29]([CH3:30])([CH3:31])[CH3:32])=[O:33].[NH2:1][c:2]1[c:3]([CH:21]2[CH:22]=[CH:23][CH2:24][CH2:25]2)[c:4]([C:19]#[N:20])[n:5][n:6]1-[c:7]1[c:8]([Cl:18])[cH:9][c:10]([C:14]([F:15])([F:16])[F:17])[cH:11][c:12]1[Cl:13]>>[c:2]1([Cl:26])[c:3]([CH:21]2[CH:22]=[CH:23][CH2:24][CH2:25]2)[c:4]([C:19]#[N:20])[n:5][n:6]1-[c:7]1[c:8]([Cl:18])[cH:9][c:10]([C:14]([F:15])([F:16])[F:17])[cH:11][c:12]1[Cl:13]Participants
6
Sources & evidence
- ORD record
- ord-164d5a9df128498a8dc3f6e08947b3fb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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