1,2-Dichloroethane → HCID 10156453, compound
Reaction equation
[CH2:37]([Cl:38])[CH2:39][Cl:40].[CH3:30][CH2:31][N:32]([CH2:33][CH3:34])[CH2:35][CH3:36].[CH:19]([CH3:20])([CH3:21])[c:22]1[c:23]([CH3:29])[cH:24][c:25]([NH2:26])[cH:27][cH:28]1.[ClH:18].[O:41]=[CH:42][N:43]([CH3:44])[CH3:45].[n:1]1[c:2]([CH2:7][S:8][c:9]2[cH:10][c:11]([C:12](=[O:13])[OH:14])[cH:15][cH:16][cH:17]2)[cH:3][n:4][cH:5][cH:6]1>>[n:1]1[c:2]([CH2:7][S:8][c:9]2[cH:10][c:11]([C:12](=[O:14])[NH:26][c:25]3[cH:24][c:23]([CH3:29])[c:22]([CH:19]([CH3:20])[CH3:21])[cH:28][cH:27]3)[cH:15][cH:16][cH:17]2)[cH:3][n:4][cH:5][cH:6]1Participants
7
Sources & evidence
- ORD record
- ord-f69e450268bc4169aa00c063deb8f38e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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