Dimethyl Sulfoxide → 6-(6-Chloro-pyridin-3-yloxymethyl)-7-(2,2-dimethyl-propyl)-7H-pyrrolo[2,3-d]pyrimidine-2-carbonitrile

HRID 1234183Notes

Reaction equation

HRID 1234183 reaction equation
[Br:1][CH2:2][c:3]1[cH:4][c:5]2[c:6]([n:7][c:8]([C:11]#[N:12])[n:9][cH:10]2)[n:13]1[CH2:14][C:15]([CH3:16])([CH3:17])[CH3:18].[CH3:38][S:39]([CH3:40])=[O:41].[Cl:24][c:25]1[n:26][cH:27][c:28]([OH:31])[cH:29][cH:30]1.[K+:32].[K+:33].[O-:34][C:35]([O-:36])=[O:37].[O:19]=[CH:20][N:21]([CH3:22])[CH3:23].[OH2:42]>>[CH2:2]([c:3]1[cH:4][c:5]2[c:6]([n:7][c:8]([C:11]#[N:12])[n:9][cH:10]2)[n:13]1[CH2:14][C:15]([CH3:16])([CH3:17])[CH3:18])[O:31][c:28]1[cH:27][n:26][c:25]([Cl:24])[cH:30][cH:29]1

Participants

8

Reactant 7

HCID 679Dimethyl SulfoxideHCID 813Potassium Cation2×HCID 962WaterHCID 6228DimethylformamideHCID 19660Carbonate IonHCID 8198212-Chloro-5-hydroxypyridineHCID 113128256-Bromomethyl-7-(2,2-dimethyl-propyl)-7H-pyrrolo[2,3-d]pyrimidine-2-carbonitrile

Product 1

HCID 101089016-(6-Chloro-pyridin-3-yloxymethyl)-7-(2,2-dimethyl-propyl)-7H-pyrrolo[2,3-d]pyrimidine-2-carbonitrile

Sources & evidence

ORD record
ord-c04a219f1b43477f9226dfe9cf387103
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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