Dimethyl Sulfoxide → 1-formylmethyl-5-{4-[2-(4-methylphenyl)benzoylamino]benzoyl}-1,3,4,5-tetrahydro-1,5-benzodiazepin-2(2H)-one
Reaction equation
[CH3:50][CH2:51][N:52]([CH2:53][CH3:54])[CH2:55][CH3:56].[CH3:7][S:8](=[O:9])[CH3:10].[Cl:1][C:2]([C:3]([Cl:4])=[O:5])=[O:6].[Cl:57][CH2:58][Cl:59].[OH:11][CH2:12][CH2:13][N:14]1[C:15](=[O:49])[CH2:16][CH2:17][N:18]([C:25]([c:26]2[cH:27][cH:28][c:29]([NH:32][C:33]([c:34]3[c:35](-[c:40]4[cH:41][cH:42][c:43]([CH3:46])[cH:44][cH:45]4)[cH:36][cH:37][cH:38][cH:39]3)=[O:47])[cH:30][cH:31]2)=[O:48])[c:19]2[c:20]1[cH:21][cH:22][cH:23][cH:24]2>>[O:11]=[CH:12][CH2:13][N:14]1[C:15](=[O:49])[CH2:16][CH2:17][N:18]([C:25]([c:26]2[cH:27][cH:28][c:29]([NH:32][C:33]([c:34]3[c:35](-[c:40]4[cH:41][cH:42][c:43]([CH3:46])[cH:44][cH:45]4)[cH:36][cH:37][cH:38][cH:39]3)=[O:47])[cH:30][cH:31]2)=[O:48])[c:19]2[c:20]1[cH:21][cH:22][cH:23][cH:24]2Participants
6
Sources & evidence
- ORD record
- ord-8a16fc466fbe4630b07d3952f8ba8df2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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