Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C17H15ClN3O5S2.Na |
| Molecular Weight | 463.891 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].CC1=C(C(=O)N[C@H]2[C@H]3SC(C)(C)[C@@H](N3C2=O)C([O-])=O)C(=NO1)C4=C(Cl)SC=C4
InChI
InChIKey=FKZGBHWHRRRGFG-MSMDOLCXSA-M
InChI=1S/C17H16ClN3O5S2.Na/c1-6-8(9(20-26-6)7-4-5-27-12(7)18)13(22)19-10-14(23)21-11(16(24)25)17(2,3)28-15(10)21;/h4-5,10-11,15H,1-3H3,(H,19,22)(H,24,25);/q;+1/p-1/t10-,11+,15-;/m1./s1
| Molecular Formula | Na |
| Molecular Weight | 22.98976928 |
| Charge | 1 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C17H15ClN3O5S2 |
| Molecular Weight | 440.901 |
| Charge | -1 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Tue Apr 01 22:06:45 GMT 2025
by
admin
on
Tue Apr 01 22:06:45 GMT 2025
|
| Record UNII |
87544HT7DM
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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Common Name | English | ||
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Preferred Name | English | ||
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Systematic Name | English |
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21079-83-4
Created by
admin on Tue Apr 01 22:06:45 GMT 2025 , Edited by admin on Tue Apr 01 22:06:45 GMT 2025
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87544HT7DM
Created by
admin on Tue Apr 01 22:06:45 GMT 2025 , Edited by admin on Tue Apr 01 22:06:45 GMT 2025
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PRIMARY | |||
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163203557
Created by
admin on Tue Apr 01 22:06:45 GMT 2025 , Edited by admin on Tue Apr 01 22:06:45 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> SALT/SOLVATE |
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