Ethanol → 1-[(aminooxy)methyl]-8-methylthio-6-phenyl-4H-s-triazolo[4,3-a][1,4]-benzodiazepine
Reaction equation
[CH3:39][CH2:40][OH:41].[CH3:4][S:5][c:6]1[cH:7][cH:8][c:9]2[c:10]([cH:38]1)[C:11]([c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1)=[N:12][CH2:13][c:14]1[n:15]-2[c:16]([CH2:19][O:20][N:21]2[C:22](=[O:23])[c:24]3[cH:25][cH:26][cH:27][cH:28][c:29]3[C:30]2=[O:31])[n:17][n:18]1.[NH2:2][NH2:3].[OH2:1]>>[CH3:4][S:5][c:6]1[cH:7][cH:8][c:9]2[c:10]([cH:38]1)[C:11]([c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1)=[N:12][CH2:13][c:14]1[n:15]-2[c:16]([CH2:19][O:20][NH2:21])[n:17][n:18]1Participants
5
Sources & evidence
- ORD record
- ord-c2d0179c5c34455b9c2c857857e8f42f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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