Acetic Acid → Thiomorpholine, 4-(2,6-difluoro-4-nitrophenyl)-, 1,1-dioxide

HRID 122837Notes

Reaction equation

HRID 122837 reaction equation
[CH3:33][C:34](=[O:35])[OH:36].[O:1]=[S:2]1(=[O:27])[CH2:3][CH2:4][N:5]([c:8]2[c:9]([F:26])[cH:10][c:11]([N:15]3[CH2:16][CH:17]([CH2:18][NH:19][C:20](=[O:21])[CH3:22])[O:23][C:24]3=[O:25])[cH:12][c:13]2[F:14])[CH2:6][CH2:7]1.[OH2:32].[OH:28][N+:29]([O-:30])=[O:31]>>[O:1]=[S:2]1(=[O:27])[CH2:3][CH2:4][N:5]([c:8]2[c:9]([F:26])[cH:10][c:11]([N+:29]([O-:28])=[O:31])[cH:12][c:13]2[F:14])[CH2:6][CH2:7]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 944Nitric AcidHCID 962WaterHCID 23432887n-((3-(4-(1,1-Dioxidothiomorpholin-4-yl)-3,5-difluorophenyl)-2-oxo-1,3-oxazolidin-5-yl)methyl)acetamide

Product 1

HCID 9922094Thiomorpholine, 4-(2,6-difluoro-4-nitrophenyl)-, 1,1-dioxide

Sources & evidence

ORD record
ord-6084076cd7b04d3f9920796ed478ee38
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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