Acetonitrile → methyl 2-[(3-methoxy-5-methyl-4-phenylmethoxyphenyl)methyl]-4-oxo-4-[4-(2-oxo-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)piperidin-1-yl]butanoate
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([O:26][CH3:27])[cH:11][c:12]([CH2:13][CH:14]([C:15](=[O:16])[O:17][CH3:18])[CH2:19][C:20](=[O:21])[O-:22])[cH:23][c:24]1[CH3:25].[CH2:69]1[O:70][CH2:71][CH2:72][CH2:73]1.[CH3:46][N:47]([CH3:48])[CH2:49][CH2:50][CH2:51][N:52]=[C:53]=[N:54][CH2:55][CH3:56].[CH3:57][N:58]([CH3:59])[c:60]1[cH:61][cH:62][n:63][cH:64][cH:65]1.[CH3:66][C:67]#[N:68].[NH:28]1[CH2:29][CH2:30][CH:31]([N:34]2[C:35](=[O:45])[NH:36][c:37]3[c:38]([cH:41][cH:42][cH:43][cH:44]3)[CH2:39][CH2:40]2)[CH2:32][CH2:33]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([O:26][CH3:27])[cH:11][c:12]([CH2:13][CH:14]([C:15](=[O:16])[O:17][CH3:18])[CH2:19][C:20](=[O:21])[N:28]2[CH2:29][CH2:30][CH:31]([N:34]3[C:35](=[O:45])[NH:36][c:37]4[c:38]([cH:41][cH:42][cH:43][cH:44]4)[CH2:39][CH2:40]3)[CH2:32][CH2:33]2)[cH:23][c:24]1[CH3:25]Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-7e099d3bd32b402da15be07ff6ccd49f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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