Acetone → Fluoromidine

HRID 170865

Reaction equation

HRID 170865 reaction equation
[C:22](=[O:23])([OH:24])[O-:25].[CH3:1][S:2]([O:3][n:6]1[c:7]([C:16]([F:17])([F:18])[F:19])[n:8][c:9]2[n:10][cH:11][c:12]([Cl:15])[cH:13][c:14]12)(=[O:4])=[O:5].[CH3:26][C:27](=[O:28])[CH3:29].[I-:21].[Na+:20]>>[nH:6]1[c:7]([C:16]([F:17])([F:18])[F:19])[n:8][c:9]2[n:10][cH:11][c:12]([Cl:15])[cH:13][c:14]12

Participants

6

Reactant 5

HCID 180AcetoneHCID 769Bicarbonate IonHCID 923Sodium ionHCID 30165Iodide IonHCID 203599241-(METHYLSULFONYLOXY)-6-CHLORO-2-(TRIFLUOROMETHYL)-1H-IMIDAZO(4,5-b)PYRIDINE

Product 1

HCID 911208Fluoromidine

Sources & evidence

ORD record
ord-0b440a466c0b4737be8f38375011968d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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