Imidazole → 5-[2-Ethoxy-5-(1-imidazolyl)phenyl]-1-methyl-3-n-propyl-1,6-dihydro-7H-pyrazolo[4,3-d]-pyrimidin-7-one

HRID 157543Notes

Reaction equation

HRID 157543 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([O:22][CH2:23][CH3:24])[c:6](-[c:8]2[nH:9][c:10](=[O:21])[c:11]3[c:12]([n:13]2)[c:14]([CH2:18][CH2:19][CH3:20])[n:15][n:16]3[CH3:17])[cH:7]1.[C:30](=[O:31])([O-:32])[O-:33].[CH3:37][N:38]([CH3:39])[CH:40]=[O:41].[Cu:42].[I:36].[K+:34].[K+:35].[OH2:43].[nH:25]1[cH:26][n:27][cH:28][cH:29]1>>[c:2]1(-[n:25]2[cH:26][n:27][cH:28][cH:29]2)[cH:3][cH:4][c:5]([O:22][CH2:23][CH3:24])[c:6](-[c:8]2[nH:9][c:10](=[O:21])[c:11]3[c:12]([n:13]2)[c:14]([CH2:18][CH2:19][CH3:20])[n:15][n:16]3[CH3:17])[cH:7]1

Participants

9

Reactant 8

HCID 795ImidazoleHCID 813Potassium Cation2×HCID 962WaterHCID 6228DimethylformamideHCID 19660Carbonate IonHCID 23978CopperHCID 24841Hydrogen iodideHCID 1357385545-(5-Bromo-2-ethoxyphenyl)-1-methyl-3-propyl-1H-pyrazolo[4,3-D]pyrimidin-7(6H)-one

Product 1

HCID 1357385725-[2-Ethoxy-5-(1-imidazolyl)phenyl]-1-methyl-3-n-propyl-1,6-dihydro-7H-pyrazolo[4,3-d]-pyrimidin-7-one

Sources & evidence

ORD record
ord-06b7ff8c9dae420f82cc9bb043183245
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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