Potassium Cation → HCID 46832589, compound

HRID 166744Notes

Reaction equation

HRID 166744 reaction equation
[C:31](=[O:32])([O-:33])[O-:34].[CH3:39][N:40]1[CH2:41][CH2:42][NH:43][CH2:44][CH2:45]1.[CH3:46][N:47]([CH3:48])[CH:49]=[O:50].[Cl:1][CH2:2][CH2:3][CH2:4][CH2:5][O:6][c:7]1[cH:8][cH:9][c:10]2[c:11]([n:12](-[c:15]3[s:16][c:17]([C:27](=[O:28])[NH2:29])[c:18](-[c:20]4[cH:21][c:22]([Cl:26])[cH:23][cH:24][cH:25]4)[n:19]3)[cH:13][n:14]2)[cH:30]1.[I-:38].[K+:35].[K+:36].[K+:37]>>[CH2:2]([CH2:3][CH2:4][CH2:5][O:6][c:7]1[cH:8][cH:9][c:10]2[c:11]([n:12](-[c:15]3[s:16][c:17]([C:27](=[O:28])[NH2:29])[c:18](-[c:20]4[cH:21][c:22]([Cl:26])[cH:23][cH:24][cH:25]4)[n:19]3)[cH:13][n:14]2)[cH:30]1)[N:43]1[CH2:42][CH2:41][N:40]([CH3:39])[CH2:45][CH2:44]1

Participants

7

Reactant 6

HCID 813Potassium Cation3×HCID 6228DimethylformamideHCID 19660Carbonate IonHCID 30165Iodide IonHCID 531671-MethylpiperazineHCID 674446482-[6-(4-Chloro-butoxy)-benzoimidazol-1-yl]-4-(3-chloro-phenyl)-thiazole-5-carboxylic acid amide

Product 1

HCID 46832589HCID 46832589, compound

Sources & evidence

ORD record
ord-773a3eb73ddb4a4c90becd9316aae7c4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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