Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C16H14F3N3O3S |
| Molecular Weight | 385.361 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=C(C[S@@+]([O-])C2=NC3=C(N2)C=CC(O)=C3)N=CC=C1OCC(F)(F)F
InChI
InChIKey=IDCLTMRSSAXUNY-AREMUKBSSA-N
InChI=1S/C16H14F3N3O3S/c1-9-13(20-5-4-14(9)25-8-16(17,18)19)7-26(24)15-21-11-3-2-10(23)6-12(11)22-15/h2-6,23H,7-8H2,1H3,(H,21,22)/t26-/m1/s1
| Molecular Formula | C16H14F3N3O3S |
| Molecular Weight | 385.361 |
| 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 22:25:58 GMT 2025
by
admin
on
Mon Mar 31 22:25:58 GMT 2025
|
| Record UNII |
19SO8G9DRR
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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220609-28-9
Created by
admin on Mon Mar 31 22:25:58 GMT 2025 , Edited by admin on Mon Mar 31 22:25:58 GMT 2025
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19SO8G9DRR
Created by
admin on Mon Mar 31 22:25:58 GMT 2025 , Edited by admin on Mon Mar 31 22:25:58 GMT 2025
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27339165
Created by
admin on Mon Mar 31 22:25:58 GMT 2025 , Edited by admin on Mon Mar 31 22:25:58 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE |