Dimethyl Sulfoxide → 2-Phenoxy-5-([1,3]thiazolo[5,4-d]pyrimidin-2-yl)benzonitrile

HRID 179310Notes

Reaction equation

HRID 179310 reaction equation
[CH3:10][S:11]([CH3:12])=[O:13].[Cl:14][c:15]1[c:16]([C:30]#[N:31])[cH:17][c:18](-[c:21]2[s:22][c:23]3[n:24][cH:25][n:26][cH:27][c:28]3[n:29]2)[cH:19][cH:20]1.[H-:8].[Na+:9].[OH2:32].[OH:1][c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1>>[O:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:15]1[c:16]([C:30]#[N:31])[cH:17][c:18](-[c:21]2[s:22][c:23]3[n:24][cH:25][n:26][cH:27][c:28]3[n:29]2)[cH:19][cH:20]1

Participants

7

Reactant 6

HCID 679Dimethyl SulfoxideHCID 923Sodium ionHCID 962WaterHCID 996PhenolHCID 166653HydrideHCID 672131822-(4-Chloro-3-cyanophenyl)thiazolo[5,4-d]pyrimidine

Product 1

HCID 248558012-Phenoxy-5-([1,3]thiazolo[5,4-d]pyrimidin-2-yl)benzonitrile

Sources & evidence

ORD record
ord-802c774c84ac4bacbaf591095c9a01b0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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