Potassium Cation → 1-(3-(Benzylthio)-2-methylphenyl)pyrrolidin-2-one

HRID 1142380Notes

Reaction equation

HRID 1142380 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[S:8][c:9]1[c:10]([CH3:16])[c:11]([Br:15])[cH:12][cH:13][cH:14]1.[CH3:29][c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1.[Cu:36][I:37].[K+:23].[K+:24].[O-:25][C:26]([O-:27])=[O:28].[O:17]=[C:18]1[CH2:19][CH2:20][CH2:21][NH:22]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[S:8][c:9]1[c:10]([CH3:16])[c:11]([N:22]2[C:18](=[O:17])[CH2:19][CH2:20][CH2:21]2)[cH:12][cH:13][cH:14]1

Participants

7

Reactant 6

HCID 813Potassium Cation2×HCID 1140TolueneHCID 120252-PyrrolidoneHCID 19660Carbonate IonHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 66911186Benzyl(3-bromo-2-methylphenyl)sulfane

Product 1

HCID 669111271-(3-(Benzylthio)-2-methylphenyl)pyrrolidin-2-one

Sources & evidence

ORD record
ord-ae8a392235564e7a9c4ca6b2bdcfcfc6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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