1,2-Dichloroethane → HCID 178432869, compound
Reaction equation
[CH2:41]([Cl:42])[CH2:43][Cl:44].[CH3:50][CH2:51][O:52][C:53]([CH3:54])=[O:55].[Cl:21][c:22]1[n:23][c:24]([CH3:30])[nH:25][c:26]1[C:27](=[O:28])[OH:29].[NH2:1][CH2:2][c:3]1[c:4]([F:20])[c:5]([O:10][c:11]2[cH:12][c:13]([C:14]#[N:15])[cH:16][c:17]([Br:19])[cH:18]2)[c:6]([Cl:9])[cH:7][cH:8]1.[O:45]=[CH:46][N:47]([CH3:48])[CH3:49].[OH:31][n:32]1[c:33]2[c:34]([cH:35][cH:36][cH:37][cH:38]2)[n:39][n:40]1>>[NH:1]([CH2:2][c:3]1[c:4]([F:20])[c:5]([O:10][c:11]2[cH:12][c:13]([C:14]#[N:15])[cH:16][c:17]([Br:19])[cH:18]2)[c:6]([Cl:9])[cH:7][cH:8]1)[C:27]([c:26]1[c:22]([Cl:21])[n:23][c:24]([CH3:30])[nH:25]1)=[O:28]Participants
7
Sources & evidence
- ORD record
- ord-772ffe64800d4b909b9ac843ea0b550b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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