1,1-Dichloroethane → HCID 67045760, compound
Reaction equation
[CH3:13][CH:14]1[N:15]([S:32](=[O:33])(=[O:34])[c:35]2[c:36]3[c:40]([cH:41][cH:42][cH:43]2)[CH2:39][CH:38]([C:44](=[O:45])[NH2:46])[CH2:37]3)[CH:16]([CH3:31])[CH2:17][N:18]([c:20]2[cH:21][cH:22][c:23]([O:26][C:27]([F:28])([F:29])[F:30])[cH:24][cH:25]2)[CH2:19]1.[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[Cl:47][CH:48]([Cl:49])[CH3:50].[P:8]([Cl:9])([Cl:10])([Cl:11])=[O:12]>>[CH3:13][CH:14]1[N:15]([S:32](=[O:33])(=[O:34])[c:35]2[c:36]3[c:40]([cH:41][cH:42][cH:43]2)[CH2:39][CH:38]([C:44]#[N:46])[CH2:37]3)[CH:16]([CH3:31])[CH2:17][N:18]([c:20]2[cH:21][cH:22][c:23]([O:26][C:27]([F:28])([F:29])[F:30])[cH:24][cH:25]2)[CH2:19]1Participants
5
Sources & evidence
- ORD record
- ord-57d3f033b0864419a8c52100461f24cb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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