1,2-Dichloroethane → HCID 178451721, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH:9]([C:10](=[O:11])[OH:12])[CH2:13][CH2:14][CH2:15]1.[CH2:33]([Cl:34])[CH2:35][Cl:36].[O:47]=[CH:48][N:49]([CH3:50])[CH3:51].[OH:37][n:38]1[c:39]2[n:40][cH:41][cH:42][cH:43][c:44]2[n:45][n:46]1.[n:16]1(-[c:21]2[c:22]([CH2:31][NH2:32])[cH:23][c:24]([C:27]([F:28])([F:29])[F:30])[cH:25][cH:26]2)[n:17][n:18][n:19][cH:20]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH:9]([C:10](=[O:12])[NH:32][CH2:31][c:22]2[c:21](-[n:16]3[n:17][n:18][n:19][cH:20]3)[cH:26][cH:25][c:24]([C:27]([F:28])([F:29])[F:30])[cH:23]2)[CH2:13][CH2:14][CH2:15]1Participants
6
Sources & evidence
- ORD record
- ord-fa37490e929f4182b6a1ba36e78423f9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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