Dimethyl Sulfoxide → 6-[4-(4-Bromo-phenylmercapto)-butoxy]-4,4-dimethyl-4H-3,1-benzoxazin-2-one

HRID 950558Notes

Reaction equation

HRID 950558 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([SH:8])[cH:6][cH:7]1.[C:9](=[O:10])([O-:11])[O-:12].[CH3:15][S:16]([CH3:17])=[O:18].[Cl:19][CH2:20][CH2:21][CH2:22][CH2:23][O:24][c:25]1[cH:26][cH:27][c:28]2[c:29]([cH:37]1)[C:30]([CH3:35])([CH3:36])[O:31][C:32](=[O:34])[NH:33]2.[K+:13].[K+:14].[OH2:38]>>[Br:1][c:2]1[cH:3][cH:4][c:5]([S:8][CH2:20][CH2:21][CH2:22][CH2:23][O:24][c:25]2[cH:26][cH:27][c:28]3[c:29]([cH:37]2)[C:30]([CH3:35])([CH3:36])[O:31][C:32](=[O:34])[NH:33]3)[cH:6][cH:7]1

Participants

7

Reactant 6

HCID 679Dimethyl SulfoxideHCID 813Potassium Cation2×HCID 962WaterHCID 19660Carbonate IonHCID 660494-BromothiophenolHCID 132605036-(4-Chlorobutoxy)-4,4-dimethyl-1,4-dihydro-2H-3,1-benzoxazin-2-one

Product 1

HCID 132605086-[4-(4-Bromo-phenylmercapto)-butoxy]-4,4-dimethyl-4H-3,1-benzoxazin-2-one

Sources & evidence

ORD record
ord-fe140a1feaa04cd89a5a90b69d209a12
Source dataset
Validation data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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