Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C21H20FN2O4S.Na |
| Molecular Weight | 438.448 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].[O-]C(=O)CCN1C2=C(C[C@@H](CC2)NS(=O)(=O)C3=CC=C(F)C=C3)C4=C1C=CC=C4
InChI
InChIKey=JRBVAOJTPBHRQQ-XFULWGLBSA-M
InChI=1S/C21H21FN2O4S.Na/c22-14-5-8-16(9-6-14)29(27,28)23-15-7-10-20-18(13-15)17-3-1-2-4-19(17)24(20)12-11-21(25)26;/h1-6,8-9,15,23H,7,10-13H2,(H,25,26);/q;+1/p-1/t15-;/m1./s1
| Molecular Formula | C21H20FN2O4S |
| Molecular Weight | 415.458 |
| Charge | -1 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | Na |
| Molecular Weight | 22.9898 |
| Charge | 1 |
| 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
Fri Dec 15 15:30:10 UTC 2023
by
admin
on
Fri Dec 15 15:30:10 UTC 2023
|
| Record UNII |
5J3I129AXS
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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1040405-44-4
Created by
admin on Fri Dec 15 15:30:10 UTC 2023 , Edited by admin on Fri Dec 15 15:30:10 UTC 2023
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67027609
Created by
admin on Fri Dec 15 15:30:10 UTC 2023 , Edited by admin on Fri Dec 15 15:30:10 UTC 2023
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5J3I129AXS
Created by
admin on Fri Dec 15 15:30:10 UTC 2023 , Edited by admin on Fri Dec 15 15:30:10 UTC 2023
|
PRIMARY |
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PARENT -> SALT/SOLVATE |
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|---|---|---|---|---|
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ACTIVE MOIETY |