Methane → 3-[3-(1-tert-butylcarbonylmethyl-2-oxo-5-phenyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-3-yl)ureido]benzoic acid
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[C:5](=[O:6])[CH2:7][N:8]1[C:9](=[O:45])[CH:10]([NH:25][C:26](=[O:27])[NH:28][c:29]2[cH:30][c:31]([C:35](=[O:36])[O:37][CH2:38][c:39]3[cH:40][cH:41][cH:42][cH:43][cH:44]3)[cH:32][cH:33][cH:34]2)[CH2:11][N:12]([c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[c:13]2[c:14]1[cH:15][cH:16][cH:17][cH:18]2.[C:46].[CH3:48][OH:49].[Pd:47]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[C:5](=[O:6])[CH2:7][N:8]1[C:9](=[O:45])[CH:10]([NH:25][C:26](=[O:27])[NH:28][c:29]2[cH:30][c:31]([C:35](=[O:36])[OH:37])[cH:32][cH:33][cH:34]2)[CH2:11][N:12]([c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[c:13]2[c:14]1[cH:15][cH:16][cH:17][cH:18]2Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-0cf90e2eefbd41749e00a43548564b24
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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