Ethanol → 1-{3-Fluoro-4-[6-methoxy-7-(2-methyl-octahydro-cyclopenta[c]pyrrol-5-ylmethoxy)-quinolin-4-yloxy]-phenyl}-3-phenylacetyl-thiourea
Reaction equation
[CH3:33][c:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1.[CH3:52][CH2:53][OH:54].[F:1][c:2]1[cH:3][c:4]([NH2:32])[cH:5][cH:6][c:7]1[O:8][c:9]1[cH:10][cH:11][n:12][c:13]2[cH:14][c:15]([O:21][CH2:22][CH:23]3[CH2:24][CH:25]4[CH:26]([CH2:27][N:28]([CH3:30])[CH2:29]4)[CH2:31]3)[c:16]([O:19][CH3:20])[cH:17][c:18]12.[c:40]1([CH2:46][C:47](=[O:48])[N:49]=[C:50]=[S:51])[cH:41][cH:42][cH:43][cH:44][cH:45]1>>[F:1][c:2]1[cH:3][c:4]([NH:32][C:50]([NH:49][C:47]([CH2:46][c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)=[O:48])=[S:51])[cH:5][cH:6][c:7]1[O:8][c:9]1[cH:10][cH:11][n:12][c:13]2[cH:14][c:15]([O:21][CH2:22][CH:23]3[CH2:24][CH:25]4[CH:26]([CH2:27][N:28]([CH3:30])[CH2:29]4)[CH2:31]3)[c:16]([O:19][CH3:20])[cH:17][c:18]12Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-8916615363784e6091e12b380219a6d0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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