1,2-Dichloroethane → HCID 54414104, compound
Reaction equation
[CH3:1][S:2]([OH:3])(=[O:4])=[O:5].[Cl:46][CH2:47][CH2:48][Cl:49].[N:6]1([CH2:12][c:13]2[cH:14][c:15]([O:19][CH2:20][CH:21]=[CH:22][CH2:23][NH:24][C:25]([CH2:26][S:27][CH2:28][CH2:29][O:30][C:31]([CH3:32])=[O:33])=[O:34])[n:16][cH:17][cH:18]2)[CH2:7][CH2:8][CH2:9][CH2:10][CH2:11]1.[OH:35][O:36][C:37]([c:38]1[cH:39][c:40]([Cl:41])[cH:42][cH:43][cH:44]1)=[O:45]>>[O:3]=[S:27]([CH2:26][C:25]([NH:24][CH2:23][CH:22]=[CH:21][CH2:20][O:19][c:15]1[cH:14][c:13]([CH2:12][N:6]2[CH2:7][CH2:8][CH2:9][CH2:10][CH2:11]2)[cH:18][cH:17][n:16]1)=[O:34])[CH2:28][CH2:29][O:30][C:31]([CH3:32])=[O:33]Participants
5
Sources & evidence
- ORD record
- ord-3e6a04f4d9224751b8fac7b94bac515c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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