Ethyl 3-(3-cyanophenyl)-3-oxopropanoate → {2-[3-(3-Cyano-phenyl)-3-oxo-propionylamino]-4-thiazol-2-ylethynyl-phenyl}-carbamic acid tert.-butyl ester
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[c:9]([NH2:21])[cH:10][c:11]([C:14]#[C:15][c:16]2[s:17][cH:18][cH:19][n:20]2)[cH:12][cH:13]1)=[O:22].[CH2:23]([O:25][C:26](=[O:24])[CH2:27][C:28](=[O:29])[c:30]1[cH:31][c:32]([C:36]#[N:37])[cH:33][cH:34][cH:35]1)[CH3:38]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[c:9]([NH:21][C:26](=[O:25])[CH2:27][C:28](=[O:29])[c:30]2[cH:31][c:32]([C:36]#[N:37])[cH:33][cH:34][cH:35]2)[cH:10][c:11]([C:14]#[C:15][c:16]2[s:17][cH:18][cH:19][n:20]2)[cH:12][cH:13]1)=[O:22]Participants
3
Sources & evidence
- ORD record
- ord-22af9547fb45472ea722670a4cc85343
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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