1,2-Dichloroethane → HCID 21963415, compound
Reaction equation
[C:29]([OH:30])(=[O:31])[CH3:32].[CH2:33]([Cl:34])[CH2:35][Cl:36].[CH3:25][C:26]([CH3:27])=[O:28].[s:1]1[n:2][c:3]([N:10]2[CH2:11][CH2:12][N:13]([CH2:16][CH2:17][c:18]3[c:19]([NH2:24])[cH:20][cH:21][cH:22][cH:23]3)[CH2:14][CH2:15]2)[c:4]2[c:5]1[cH:6][cH:7][cH:8][cH:9]2>>[s:1]1[n:2][c:3]([N:10]2[CH2:11][CH2:12][N:13]([CH2:16][CH2:17][c:18]3[c:19]([NH:24][CH:26]([CH3:25])[CH3:27])[cH:20][cH:21][cH:22][cH:23]3)[CH2:14][CH2:15]2)[c:4]2[c:5]1[cH:6][cH:7][cH:8][cH:9]2Participants
5
Sources & evidence
- ORD record
- ord-bc3c362662184a4a8f63b652dd3a11f7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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