Potassium Cation → 2-(2-Chloro-6-nitrophenyl)sulfanyl-1-[(2-methyloxiran-2-yl)methyl]-4-nitroimidazole

HRID 2159135Notes

Reaction equation

HRID 2159135 reaction equation
[C:25](=[O:26])([O-:27])[O-:28].[CH3:20][N:21]([CH3:22])[CH:23]=[O:24].[CH3:33][CH2:34][O:35][C:36]([CH3:37])=[O:38].[Cl:1][c:2]1[c:3]([S:11][c:12]2[nH:13][cH:14][c:15]([N+:17](=[O:18])[O-:19])[n:16]2)[c:4]([N+:8](=[O:9])[O-:10])[cH:5][cH:6][cH:7]1.[Cs+:32].[F-:31].[K+:29].[K+:30].[OH2:39]>>[Cl:1][c:2]1[c:3]([S:11][c:12]2[n:13]([CH2:20][C:36]3([CH3:37])[CH2:34][O:35]3)[cH:14][c:15]([N+:17](=[O:18])[O-:19])[n:16]2)[c:4]([N+:8](=[O:9])[O-:10])[cH:5][cH:6][cH:7]1

Participants

9

Reactant 8

HCID 813Potassium Cation2×HCID 962WaterHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 28179Fluoride IonHCID 104967Cesium cationHCID 178526859HCID 178526859, compound

Product 1

HCID 870634242-(2-Chloro-6-nitrophenyl)sulfanyl-1-[(2-methyloxiran-2-yl)methyl]-4-nitroimidazole

Sources & evidence

ORD record
ord-558cedd47aaa4f688e79a03947df362e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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