1,2-Dichloroethane → HCID 178487922, compound
Reaction equation
[CH2:38]([Cl:39])[CH2:40][Cl:41].[NH2:1][CH2:2][CH:3]1[CH:4]([OH:23])[CH2:5][N:6]([CH2:8][CH2:9][c:10]2[c:11]([F:22])[cH:12][n:13][c:14]3[cH:15][cH:16][c:17]([O:20][CH3:21])[n:18][c:19]23)[CH2:7]1.[O:24]=[C:25]1[NH:26][c:27]2[c:28]([cH:31][cH:32][c:33]([C:35](=[O:36])[OH:37])[n:34]2)[O:29][CH2:30]1.[OH:42][n:43]1[c:44]2[c:45]([cH:46][cH:47][cH:48][cH:49]2)[n:50][n:51]1>>[NH:1]([CH2:2][CH:3]1[CH:4]([OH:23])[CH2:5][N:6]([CH2:8][CH2:9][c:10]2[c:11]([F:22])[cH:12][n:13][c:14]3[cH:15][cH:16][c:17]([O:20][CH3:21])[n:18][c:19]23)[CH2:7]1)[C:35]([c:33]1[cH:32][cH:31][c:28]2[c:27]([n:34]1)[NH:26][C:25](=[O:24])[CH2:30][O:29]2)=[O:36]Participants
5
Sources & evidence
- ORD record
- ord-a1b9b1048c54459faabca33724a68994
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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