2-(Dimethylamino)ethanol → HCID 178483866, compound
Reaction equation
[CH3:28][N:29]([CH2:30][CH2:31][OH:32])[CH3:33].[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9]([C:20](=[O:21])[NH:22][c:23]3[s:24][cH:25][cH:26][n:27]3)[n:10][c:11](-[c:13]3[cH:14][cH:15][c:16]([OH:19])[cH:17][cH:18]3)[nH:12]2)[cH:6][cH:7]1.[O:53]=[C:54]([O:55][CH2:56][CH3:57])[N:58]=[N:59][C:60]([O:61][CH2:62][CH3:63])=[O:64].[c:34]1([P:35]([c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[cH:48][cH:49][cH:50][cH:51][cH:52]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9]([C:20](=[O:21])[NH:22][c:23]3[s:24][cH:25][cH:26][n:27]3)[n:10][c:11](-[c:13]3[cH:14][cH:15][c:16]([O:19][CH2:31][CH2:30][N:29]([CH3:28])[CH3:33])[cH:17][cH:18]3)[nH:12]2)[cH:6][cH:7]1Participants
5
Sources & evidence
- ORD record
- ord-1dafbc2392dc4d9fba81d41a62cf770b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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