1,2-Dichloroethane → HCID 178425846, compound
Reaction equation
[CH3:17][C:18]([C:19]#[C:20][c:21]1[cH:22][c:23]([NH:26][CH:27]2[CH2:28][CH2:29][C:30]3([O:31][CH2:32][CH2:33][O:34]3)[CH2:35][CH2:36]2)[cH:24][s:25]1)([CH3:37])[CH3:38].[CH3:1][C:2]1=[CH:3][CH2:4][CH:5]([C:9](=[O:10])[OH:11])[CH:6]([CH3:8])[CH2:7]1.[CH:39]([N:40]([CH:41]([CH3:42])[CH3:43])[CH2:44][CH3:45])([CH3:46])[CH3:47].[Cl:48][CH2:49][Cl:50].[Cl:51][CH2:52][CH2:53][Cl:54].[O:12]=[CH:13][N:14]([CH3:15])[CH3:16]>>[CH3:1][C:2]1=[CH:3][CH2:4][CH:5]([C:9](=[O:11])[N:26]([c:23]2[cH:22][c:21]([C:20]#[C:19][C:18]([CH3:17])([CH3:37])[CH3:38])[s:25][cH:24]2)[CH:27]2[CH2:28][CH2:29][C:30]3([O:31][CH2:32][CH2:33][O:34]3)[CH2:35][CH2:36]2)[CH:6]([CH3:8])[CH2:7]1Participants
7
Sources & evidence
- ORD record
- ord-3159e622879b428792ed333ed9362071
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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