Potassium Cation → HCID 16005346, compound

HRID 189325Notes

Reaction equation

HRID 189325 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([CH2:8][n:9]2[n:10][c:11]3[n:12]([cH:13][cH:14][c:15](-[c:23]4[cH:24][cH:25][c:26]([Cl:29])[cH:27][cH:28]4)[c:16]3-[c:17]3[cH:18][cH:19][n:20][cH:21][cH:22]3)[c:30]2=[O:31])[n:6][cH:7]1.[C:37](=[O:38])([O-:39])[O-:40].[CH3:43][N:44]([CH3:45])[CH2:46][CH2:47][NH2:48].[CH3:49][c:50]1[cH:51][cH:52][cH:53][cH:54][cH:55]1.[CH3:56][CH2:57][O:58][C:59]([CH3:60])=[O:61].[Cu:62][I:63].[K+:41].[K+:42].[nH:32]1[n:33][cH:34][cH:35][cH:36]1>>[c:2]1(-[n:32]2[n:33][cH:34][cH:35][cH:36]2)[cH:3][cH:4][c:5]([CH2:8][n:9]2[n:10][c:11]3[n:12]([cH:13][cH:14][c:15](-[c:23]4[cH:24][cH:25][c:26]([Cl:29])[cH:27][cH:28]4)[c:16]3-[c:17]3[cH:18][cH:19][n:20][cH:21][cH:22]3)[c:30]2=[O:31])[n:6][cH:7]1

Participants

9

Reactant 8

HCID 813Potassium Cation2×HCID 1048PyrazoleHCID 1140TolueneHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 66053N,N-DimethylethylenediamineHCID 16005345HCID 16005345, compound

Product 1

HCID 16005346HCID 16005346, compound

Sources & evidence

ORD record
ord-5ed0c8a0afe1449b9a0b2a1033265a2c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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