2,3-Dichlorobenzenethiol → 6-[2-(3-chloro-4-methoxyphenyl)ethyl]6-cyclopentyl-3-[(2,3-dichlorophenyl)thio]4-hydroxy-5,6-dihydro-2H-pyran-2-one

HRID 2133017Notes

Reaction equation

HRID 2133017 reaction equation
[Cl:1][CH:2]1[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].[Cl:26][c:27]1[c:28]([SH:34])[cH:29][cH:30][cH:31][c:32]1[Cl:33]>>[C:2]1([S:34][c:28]2[c:27]([Cl:26])[c:32]([Cl:33])[cH:31][cH:30][cH:29]2)=[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]

Participants

3

Reactant 2

HCID 1402022,3-DichlorobenzenethiolHCID 688674513-Chloro-6-[2-(3-chloro-4-methoxy-phenyl)-ethyl]-6-cyclopentyl-dihydro-pyran-2,4-dione

Product 1

HCID 587625726-[2-(3-chloro-4-methoxyphenyl)ethyl]6-cyclopentyl-3-[(2,3-dichlorophenyl)thio]4-hydroxy-5,6-dihydro-2H-pyran-2-one

Sources & evidence

ORD record
ord-1e457da6a11441df83535c6aabd01157
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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