Acetic Acid → N-({2-[(cyclopentylmethyl)(ethyl)amino]-5-(trifluoromethyl)phenyl}methyl)-5-[2-(methylthio)ethoxy]pyrimidin-2-amine
Reaction equation
[C:38]([O:39][BH-:40]([O:41][C:42](=[O:43])[CH3:44])[O:45][C:46](=[O:47])[CH3:48])(=[O:49])[CH3:50].[CH3:22][S:23][CH2:24][CH2:25][O:26][c:27]1[cH:28][n:29][c:30]([NH2:33])[n:31][cH:32]1.[CH3:34][C:35](=[O:36])[OH:37].[CH3:52][c:53]1[cH:54][cH:55][cH:56][cH:57][cH:58]1.[CH:1]1([CH2:6][N:7]([c:8]2[c:9]([CH:10]=[O:11])[cH:12][c:13]([C:16]([F:17])([F:18])[F:19])[cH:14][cH:15]2)[CH2:20][CH3:21])[CH2:2][CH2:3][CH2:4][CH2:5]1.[Na+:51].[OH2:59]>>[CH:1]1([CH2:6][N:7]([c:8]2[c:9]([CH2:10][NH:33][c:30]3[n:29][cH:28][c:27]([O:26][CH2:25][CH2:24][S:23][CH3:22])[cH:32][n:31]3)[cH:12][c:13]([C:16]([F:17])([F:18])[F:19])[cH:14][cH:15]2)[CH2:20][CH3:21])[CH2:2][CH2:3][CH2:4][CH2:5]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-ea9c793bd5fe4866b9fd18830bfefb50
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
Loading…