Ethyl isocyanate → N-ethyl-N'-[4-(2-methyl-5-{1-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]pyridin-4-yl}-1,3-oxazol-4-yl)phenyl]urea
Reaction equation
[CH2:33]([CH3:34])[N:35]=[C:36]=[O:37].[CH3:1][c:2]1[o:3][c:4](-[c:14]2[c:15]3[c:16]([n:17][cH:18][cH:19]2)[n:20]([S:23](=[O:24])(=[O:25])[c:26]2[cH:27][cH:28][c:29]([CH3:32])[cH:30][cH:31]2)[cH:21][cH:22]3)[c:5](-[c:7]2[cH:8][cH:9][c:10]([NH2:11])[cH:12][cH:13]2)[n:6]1>>[CH3:1][c:2]1[o:3][c:4](-[c:14]2[c:15]3[c:16]([n:17][cH:18][cH:19]2)[n:20]([S:23](=[O:24])(=[O:25])[c:26]2[cH:27][cH:28][c:29]([CH3:32])[cH:30][cH:31]2)[cH:21][cH:22]3)[c:5](-[c:7]2[cH:8][cH:9][c:10]([NH:11][C:36]([NH:35][CH2:33][CH3:34])=[O:37])[cH:12][cH:13]2)[n:6]1Participants
3
Sources & evidence
- ORD record
- ord-fd78cc55ab8d46fdbcb7650d72123c9a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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