1,2-Dichloroethane → HCID 178495044, compound
Reaction equation
[Cl:51][CH2:52][CH2:53][Cl:54].[F:44][C:45]([F:46])([F:47])[C:48]([OH:49])=[O:50].[N:1]1([C:5](=[O:6])[CH:7]2[CH2:8][N:9]([C:37]([O:38][C:39]([CH3:40])([CH3:41])[CH3:42])=[O:43])[CH2:10][CH:11]([N:13]([CH2:14][CH:15]([CH3:16])[CH3:17])[C:18](=[O:19])[c:20]3[n:21][c:22]4[c:23]([n:24]3[CH2:25][CH2:26][CH2:27][CH2:28][O:29][CH3:30])[cH:31][c:32]([F:36])[c:33]([F:35])[cH:34]4)[CH2:12]2)[CH2:2][CH2:3][CH2:4]1>>[N:1]1([C:5](=[O:6])[CH:7]2[CH2:8][NH:9][CH2:10][CH:11]([N:13]([CH2:14][CH:15]([CH3:16])[CH3:17])[C:18](=[O:19])[c:20]3[n:21][c:22]4[c:23]([n:24]3[CH2:25][CH2:26][CH2:27][CH2:28][O:29][CH3:30])[cH:31][c:32]([F:36])[c:33]([F:35])[cH:34]4)[CH2:12]2)[CH2:2][CH2:3][CH2:4]1Participants
4
Sources & evidence
- ORD record
- ord-6dba50f3c7664539a74dcebd6db1f06f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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