Dimethyl Sulfoxide → HCID 22560067, compound

HRID 137817Notes

Reaction equation

HRID 137817 reaction equation
[CH3:22][CH:23]1[O:24][CH:25]([CH3:29])[CH2:26][NH:27][CH2:28]1.[CH3:33][S:34]([CH3:35])=[O:36].[Cl:1][c:2]1[c:3]([C:20]#[N:21])[c:4]([CH:17]([F:18])[F:19])[n:5][n:6]1-[c:7]1[n:8][cH:9][c:10]([S:13](=[O:14])(=[O:15])[CH3:16])[cH:11][cH:12]1.[F-:30].[K+:31].[OH2:32]>>[c:2]1([N:27]2[CH2:26][CH:25]([CH3:29])[O:24][CH:23]([CH3:22])[CH2:28]2)[c:3]([C:20]#[N:21])[c:4]([CH:17]([F:18])[F:19])[n:5][n:6]1-[c:7]1[n:8][cH:9][c:10]([S:13](=[O:14])(=[O:15])[CH3:16])[cH:11][cH:12]1

Participants

7

Reactant 6

HCID 679Dimethyl SulfoxideHCID 813Potassium CationHCID 962WaterHCID 28179Fluoride IonHCID 1108622,6-DimethylmorpholineHCID 12149009HCID 12149009, compound

Product 1

HCID 22560067HCID 22560067, compound

Sources & evidence

ORD record
ord-360fd8f8f81d467da77f7e77958b36a5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

Loading…