Acetic Acid → 5-{4-[2-(4-methylphenyl)benzoylamino]benzoyl}-1-[2-(4-methyl-1-piperazinyl)ethyl]-1,3,4,5-tetrahydro-1,5-benzodiazepin-2(2H)-one
Reaction equation
[C:47]([BH3-:48])#[N:49].[C:51](=[O:52])([O-:53])[OH:54].[CH3:40][N:41]1[CH2:42][CH2:43][NH:44][CH2:45][CH2:46]1.[CH3:56][OH:57].[CH3:58][C:59](=[O:60])[OH:61].[CH:1](=[O:2])[CH2:3][N:4]1[C:5](=[O:39])[CH2:6][CH2:7][N:8]([C:15]([c:16]2[cH:17][cH:18][c:19]([NH:22][C:23]([c:24]3[c:25](-[c:30]4[cH:31][cH:32][c:33]([CH3:36])[cH:34][cH:35]4)[cH:26][cH:27][cH:28][cH:29]3)=[O:37])[cH:20][cH:21]2)=[O:38])[c:9]2[c:10]1[cH:11][cH:12][cH:13][cH:14]2.[CH:62]([Cl:63])([Cl:64])[Cl:65].[Na+:50].[Na+:55]>>[CH2:1]([CH2:3][N:4]1[C:5](=[O:39])[CH2:6][CH2:7][N:8]([C:15]([c:16]2[cH:17][cH:18][c:19]([NH:22][C:23]([c:24]3[c:25](-[c:30]4[cH:31][cH:32][c:33]([CH3:36])[cH:34][cH:35]4)[cH:26][cH:27][cH:28][cH:29]3)=[O:37])[cH:20][cH:21]2)=[O:38])[c:9]2[c:10]1[cH:11][cH:12][cH:13][cH:14]2)[N:44]1[CH2:43][CH2:42][N:41]([CH3:40])[CH2:46][CH2:45]1Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-588ddb8483ff47b3ae904451ad9abd3c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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