Ammonium → HCID 67380851, compound

HRID 2331713Notes

Reaction equation

HRID 2331713 reaction equation
[C:36](=[O:37])([O-:38])[O-:39].[CH2:28]([CH3:29])[CH:30]1[NH:31][C:32](=[O:35])[O:33][CH2:34]1.[CH3:42][NH:43][CH2:44][CH2:45][NH:46][CH3:47].[CH3:52][CH2:53][O:54][C:55](=[O:56])[CH3:57].[CH3:58][c:59]1[cH:60][cH:61][cH:62][cH:63][cH:64]1.[CH:1]1([c:4]2[c:5]([N:13]3[CH2:14][CH2:15][N:16]([C:19](=[O:20])[c:21]4[cH:22][cH:23][c:24]([I:27])[cH:25][cH:26]4)[CH2:17][CH2:18]3)[n:6][cH:7][c:8]([CH:10]3[CH2:11][CH2:12]3)[cH:9]2)[CH2:2][CH2:3]1.[Cl-:48].[Cu:50][I:51].[K+:40].[K+:41].[NH4+:49]>>[CH:1]1([c:4]2[c:5]([N:13]3[CH2:14][CH2:15][N:16]([C:19](=[O:20])[c:21]4[cH:22][cH:23][c:24]([N:31]5[CH:30]([CH2:28][CH3:29])[CH2:34][O:33][C:32]5=[O:35])[cH:25][cH:26]4)[CH2:17][CH2:18]3)[n:6][cH:7][c:8]([CH:10]3[CH2:11][CH2:12]3)[cH:9]2)[CH2:2][CH2:3]1

Participants

11

Reactant 10

HCID 223AmmoniumHCID 312ChlorideHCID 813Potassium Cation2×HCID 1140TolueneHCID 8070N,N'-DimethylethylenediamineHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 977694-Ethyl-2-oxazolidinoneHCID 58484688[4-(3,5-Dicyclopropylpyridin-2-yl)piperazin-1-yl](4-iodophenyl)methanone

Product 1

HCID 67380851HCID 67380851, compound

Sources & evidence

ORD record
ord-cbfe233560fc4c6995a213e7027014b9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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