Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C9H8N3O2S2.Na.H2O |
| Molecular Weight | 295.314 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.[Na+].NC1=CC=C(C=C1)S(=O)(=O)[N-]C2=NC=CS2
InChI
InChIKey=PEVALAQKCXISJZ-UHFFFAOYSA-N
InChI=1S/C9H8N3O2S2.Na.H2O/c10-7-1-3-8(4-2-7)16(13,14)12-9-11-5-6-15-9;;/h1-6H,10H2;;1H2/q-1;+1;
| 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 |
| Molecular Formula | C9H9N3O2S2 |
| Molecular Weight | 255.317 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | HO |
| Molecular Weight | 17.0073 |
| 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 17:24:25 UTC 2023
by
admin
on
Fri Dec 15 17:24:25 UTC 2023
|
| Record UNII |
W6NDW4K12P
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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| Code System | Code | Type | Description | ||
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10135-89-4
Created by
admin on Fri Dec 15 17:24:25 UTC 2023 , Edited by admin on Fri Dec 15 17:24:25 UTC 2023
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23675776
Created by
admin on Fri Dec 15 17:24:25 UTC 2023 , Edited by admin on Fri Dec 15 17:24:25 UTC 2023
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PRIMARY | |||
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W6NDW4K12P
Created by
admin on Fri Dec 15 17:24:25 UTC 2023 , Edited by admin on Fri Dec 15 17:24:25 UTC 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
|
PARENT -> SALT/SOLVATE | |||
|
ANHYDROUS->SOLVATE |
