Acetic Acid → 1-(3-Carbamoyl-5-(4-((4-methylpiperazin-1-yl)methyl)phenyl)thiophen-2-yl)urea
Reaction equation
[C:38]([BH3-:39])#[N:40].[CH3:21][N:22]1[CH2:23][CH2:24][NH:25][CH2:26][CH2:27]1.[CH3:44][O:45][CH2:46][CH2:47][O:48][CH3:49].[CH3:50][N:51]([CH3:52])[C:53](=[O:54])[CH3:55].[CH3:56][C:57](=[O:58])[OH:59].[CH:28]([O:29][CH2:30][CH3:31])([O:32][CH2:33][CH3:34])[O:35][CH2:36][CH3:37].[N-:41]=[C:42]=[O:43].[NH2:1][C:2](=[O:3])[NH:4][c:5]1[s:6][c:7](-[c:13]2[cH:14][cH:15][c:16]([CH:19]=[O:20])[cH:17][cH:18]2)[cH:8][c:9]1[C:10](=[O:11])[NH2:12]>>[NH2:1][C:2](=[O:3])[NH:4][c:5]1[s:6][c:7](-[c:13]2[cH:14][cH:15][c:16]([CH2:19][N:25]3[CH2:24][CH2:23][N:22]([CH3:21])[CH2:27][CH2:26]3)[cH:17][cH:18]2)[cH:8][c:9]1[C:10](=[O:11])[NH2:12]Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-a8a93279053040caa9bfee8113a47be3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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