Sodium ion → A2A receptor antagonist 1

HRID 2123228Notes

Reaction equation

HRID 2123228 reaction equation
[F:18][c:19]1[c:20]([CH2:21][Br:22])[cH:23][cH:24][cH:25][cH:26]1.[H-:17].[Na+:16].[O:27]=[CH:28][N:29]([CH3:30])[CH3:31].[o:1]1[c:2](-[c:6]2[c:7]3[c:8]([n:9][c:10]([NH2:12])[n:11]2)[nH:13][n:14][cH:15]3)[cH:3][cH:4][cH:5]1>>[o:1]1[c:2](-[c:6]2[c:7]3[c:8]([n:9][c:10]([NH2:12])[n:11]2)[n:13]([CH2:21][c:20]2[c:19]([F:18])[cH:26][cH:25][cH:24][cH:23]2)[n:14][cH:15]3)[cH:3][cH:4][cH:5]1

Participants

6

Reactant 5

HCID 923Sodium ionHCID 6228DimethylformamideHCID 67968alpha-Bromo-o-fluorotolueneHCID 166653HydrideHCID 220155004-(2-Furyl)-1H-pyrazolo[3,4-d]pyrimidine-6-amine

Product 1

HCID 9879687A2A receptor antagonist 1

Sources & evidence

ORD record
ord-d6f1b8729b9f47f590ed7704b5d0e071
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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