Ethyl 4-[3-({[(5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)carbonyl]amino}methyl)phenoxy]butanoate → 4-[3-({[(5-Methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)carbonyl]amino}methyl)phenoxy]butanoic acid
Reaction equation
[CH3:44][c:45]1[cH:46][s:47][c:48]2[n:49][c:50]([C:55](=[O:56])[NH:57][CH2:58][c:59]3[cH:60][c:61]([O:62][CH2:63][CH2:64][CH2:65][C:66](=[O:67])[O:68][CH2:69][CH3:70])[cH:71][cH:72][cH:73]3)[nH:51][c:52](=[O:54])[c:53]12.[O:1]=[c:2]1[nH:3][c:4]([C:5]([NH:6][CH2:7][c:8]2[cH:9][cH:10][n:11][c:12]([O:13][CH2:14][CH2:15][CH2:16][c:17]3[n:18][cH:19][nH:20][n:21]3)[cH:22]2)=[O:23])[n:24][c:25]2[s:26][cH:27][c:28]([CH2:29][O:30][CH2:31][c:32]3[cH:33][cH:34][c:35]([C:36]([O:37][CH2:38][CH3:39])=[O:40])[cH:41][cH:42]3)[c:43]12>>[CH3:44][c:45]1[cH:46][s:47][c:48]2[n:49][c:50]([C:55](=[O:56])[NH:57][CH2:58][c:59]3[cH:60][c:61]([O:62][CH2:63][CH2:64][CH2:65][C:66](=[O:67])[OH:68])[cH:71][cH:72][cH:73]3)[nH:51][c:52](=[O:54])[c:53]12Participants
3
Sources & evidence
- ORD record
- ord-a7b3518cf6f0412a8e892239b3471466
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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