Ethanol → (3RS)-1-(2-hydroxylethyl)-3-tert-butoxycarbonylamino-5-(2-fluorophenyl)-2, 3-dihydro-1H-1,4-benzodiazepin-2-one
Reaction equation
[C:1](=[O:2])([CH3:3])[O:4][CH2:5][CH2:6][N:7]1[C:8](=[O:33])[CH:9]([NH:25][C:26](=[O:27])[O:28][C:29]([CH3:30])([CH3:31])[CH3:32])[N:10]=[C:11]([c:18]2[c:19]([F:24])[cH:20][cH:21][cH:22][cH:23]2)[c:12]2[c:13]1[cH:14][cH:15][cH:16][cH:17]2.[C:34](=[O:35])([O-:36])[O-:37].[CH3:40][CH2:41][OH:42].[K+:38].[K+:39]>>[OH:4][CH2:5][CH2:6][N:7]1[C:8](=[O:33])[CH:9]([NH:25][C:26](=[O:27])[O:28][C:29]([CH3:30])([CH3:31])[CH3:32])[N:10]=[C:11]([c:18]2[c:19]([F:24])[cH:20][cH:21][cH:22][cH:23]2)[c:12]2[c:13]1[cH:14][cH:15][cH:16][cH:17]2Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-98bb87e3ef9a44288262e1ce3c9bf955
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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