Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C15H13F2N3O7S2 |
| Molecular Weight | 449.406 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=C(C[S+]([O-])C2=NC3=C(N2)C=CC(OC(F)F)=C3)N=CC=C1OS(O)(=O)=O
InChI
InChIKey=AQQVGUHYOGVLDA-UHFFFAOYSA-N
InChI=1S/C15H13F2N3O7S2/c1-25-13-11(18-5-4-12(13)27-29(22,23)24)7-28(21)15-19-9-3-2-8(26-14(16)17)6-10(9)20-15/h2-6,14H,7H2,1H3,(H,19,20)(H,22,23,24)
| Molecular Formula | C15H13F2N3O7S2 |
| Molecular Weight | 449.406 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 22:31:57 GMT 2025
by
admin
on
Mon Mar 31 22:31:57 GMT 2025
|
| Record UNII |
V65S6495BX
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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Preferred Name | English | ||
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Common Name | English |
| Code System | Code | Type | Description | ||
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V65S6495BX
Created by
admin on Mon Mar 31 22:31:57 GMT 2025 , Edited by admin on Mon Mar 31 22:31:57 GMT 2025
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PRIMARY | |||
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1189856-53-8
Created by
admin on Mon Mar 31 22:31:57 GMT 2025 , Edited by admin on Mon Mar 31 22:31:57 GMT 2025
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45038893
Created by
admin on Mon Mar 31 22:31:57 GMT 2025 , Edited by admin on Mon Mar 31 22:31:57 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE |
