Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C17H17F2N3O4S |
| Molecular Weight | 397.396 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=C(OC)C(C[S+]([O-])C2=NC3=CC(OC(F)F)=CC=C3N2C)=NC=C1
InChI
InChIKey=NQWYXCHABHQOMJ-UHFFFAOYSA-N
InChI=1S/C17H17F2N3O4S/c1-22-13-5-4-10(26-16(18)19)8-11(13)21-17(22)27(23)9-12-15(25-3)14(24-2)6-7-20-12/h4-8,16H,9H2,1-3H3
| Molecular Formula | C17H17F2N3O4S |
| Molecular Weight | 397.396 |
| 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
Sat Dec 16 10:04:52 UTC 2023
by
admin
on
Sat Dec 16 10:04:52 UTC 2023
|
| Record UNII |
4CH8A399MM
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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21032391
Created by
admin on Sat Dec 16 10:04:53 UTC 2023 , Edited by admin on Sat Dec 16 10:04:53 UTC 2023
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4CH8A399MM
Created by
admin on Sat Dec 16 10:04:53 UTC 2023 , Edited by admin on Sat Dec 16 10:04:53 UTC 2023
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624742-53-6
Created by
admin on Sat Dec 16 10:04:53 UTC 2023 , Edited by admin on Sat Dec 16 10:04:53 UTC 2023
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> IMPURITY |
sum of impurities D and F- 0.2 per cent
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
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