Dichloromethane → 2-{2-[1-Ethyl-3-(4-trifluoromethoxyphenyl)ureido]indan-5-ylsulfanyl}-2-methylpropionic acid
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([C:7]([CH3:8])([CH3:9])[S:10][c:11]1[cH:12][c:13]2[c:17]([cH:18][cH:19]1)[CH2:16][CH:15]([N:20]([C:21](=[O:22])[NH:23][c:24]1[cH:25][cH:26][c:27]([O:30][C:31]([F:32])([F:33])[F:34])[cH:28][cH:29]1)[CH2:35][CH3:36])[CH2:14]2)=[O:37].[Cl:45][CH2:46][Cl:47].[F:38][C:39]([F:40])([F:41])[C:42]([OH:43])=[O:44]>>[O:5]=[C:6]([C:7]([CH3:8])([CH3:9])[S:10][c:11]1[cH:12][c:13]2[c:17]([cH:18][cH:19]1)[CH2:16][CH:15]([N:20]([C:21](=[O:22])[NH:23][c:24]1[cH:25][cH:26][c:27]([O:30][C:31]([F:32])([F:33])[F:34])[cH:28][cH:29]1)[CH2:35][CH3:36])[CH2:14]2)[OH:37]Participants
4
Sources & evidence
- ORD record
- ord-2ca980ab99454ea98f38852a2147f016
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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