3-chloro-6-[2-(3-chloro-4-methoxyphenyl)ethyl]6-cyclopentyl-4-hydroxy-5,6-dihydro-2H-pyran-2-one → 6-[2-(3-Chloro-4-methoxy-phenyl)-ethyl]-6-cyclopentyl-3-(5-phenyl-4H-[1,2,4]triazol-3-ylsulfanyl)-dihydro-pyran-2,4-dione
Reaction equation
[Cl:1][C:2]1=[C:7]([OH:8])[CH2:6][C:5]([CH:9]2[CH2:10][CH2:11][CH2:12][CH2:13]2)([CH2:14][CH2:15][c:16]2[cH:17][c:18]([Cl:24])[c:19]([O:22][CH3:23])[cH:20][cH:21]2)[O:4][C:3]1=[O:25].[Cl:26][C:27]1=[C:46]([OH:47])[CH2:45][C:31]([CH2:32][CH2:33][C:34]2=[CH:39][CH2:38][CH2:37][CH2:36][CH2:35]2)([CH:40]2[CH2:41][CH2:42][CH2:43][CH2:44]2)[O:30][C:28]1=[O:29].[c:48]1(-[c:54]2[n:55][c:56]([SH:59])[n:57][nH:58]2)[cH:49][cH:50][cH:51][cH:52][cH:53]1.[n:60]1[cH:61][cH:62][c:63](-[c:64]2[nH:65][c:66]([SH:67])[n:68][n:69]2)[cH:70][cH:71]1>>[CH:2]1([S:59][c:56]2[nH:55][c:54](-[c:48]3[cH:49][cH:50][cH:51][cH:52][cH:53]3)[n:58][n:57]2)[C:3](=[O:25])[O:4][C:5]([CH:9]2[CH2:10][CH2:11][CH2:12][CH2:13]2)([CH2:14][CH2:15][c:16]2[cH:17][c:18]([Cl:24])[c:19]([O:22][CH3:23])[cH:20][cH:21]2)[CH2:6][C:7]1=[O:8]Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-48c37edc169b46c28cbbc30b89214e72
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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