Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C13H12N5O5S2.Na |
Molecular Weight | 405.385 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].[H][C@]12SCC=C(N1C(=O)[C@H]2NC(=O)C(=N\OC)\C3=CSC(N)=N3)C([O-])=O
InChI
InChIKey=ADLFUPFRVXCDMO-GIXFXUBFSA-M
InChI=1S/C13H13N5O5S2.Na/c1-23-17-7(5-4-25-13(14)15-5)9(19)16-8-10(20)18-6(12(21)22)2-3-24-11(8)18;/h2,4,8,11H,3H2,1H3,(H2,14,15)(H,16,19)(H,21,22);/q;+1/p-1/b17-7+;/t8-,11-;/m1./s1
Molecular Formula | C13H12N5O5S2 |
Molecular Weight | 382.395 |
Charge | -1 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 1 |
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
Sat Dec 16 19:52:36 GMT 2023
by
admin
on
Sat Dec 16 19:52:36 GMT 2023
|
Record UNII |
9XA88DMN9R
|
Record Status |
Validated (UNII)
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Record Version |
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-
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51066536
Created by
admin on Sat Dec 16 19:52:36 GMT 2023 , Edited by admin on Sat Dec 16 19:52:36 GMT 2023
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9XA88DMN9R
Created by
admin on Sat Dec 16 19:52:36 GMT 2023 , Edited by admin on Sat Dec 16 19:52:36 GMT 2023
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PRIMARY |