Acetic Acid → 2-[4-(10-Methylthieno[3,4-b][1,5]benzodiazepin-4-yl)piperazin-1-yl]ethanol
Reaction equation
[CH3:1][N:2]1[c:3]2[c:4]([cH:15][s:16][cH:17]2)[C:5]([S:13][CH3:14])=[N:6][c:7]2[c:8]1[cH:9][cH:10][cH:11][cH:12]2.[CH3:27][C:28](=[O:29])[OH:30].[CH3:39][CH2:40][OH:41].[OH:18][CH2:19][CH2:20][N:21]1[CH2:22][CH2:23][NH:24][CH2:25][CH2:26]1.[OH:31][C:32]([CH:33]=[CH:34][C:35](=[O:36])[OH:37])=[O:38].[c:42]1([CH3:43])[c:44]([CH3:45])[cH:46][cH:47][cH:48][cH:49]1>>[CH3:1][N:2]1[c:3]2[c:4]([cH:15][s:16][cH:17]2)[C:5]([N:24]2[CH2:23][CH2:22][N:21]([CH2:20][CH2:19][OH:18])[CH2:26][CH2:25]2)=[N:6][c:7]2[c:8]1[cH:9][cH:10][cH:11][cH:12]2Participants
7
Sources & evidence
- ORD record
- ord-8f10286ee1d84469ae496627ec0d1955
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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