Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C20H19N2O4S2.Na |
| Molecular Weight | 438.496 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].CC1=CSC(=C1C(=O)N[C@H]2[C@H]3SC(C)(C)[C@@H](N3C2=O)C([O-])=O)C4=CC=CC=C4
InChI
InChIKey=QLPHZIIRKHPVPG-DLZWMXSCSA-M
InChI=1S/C20H20N2O4S2.Na/c1-10-9-27-14(11-7-5-4-6-8-11)12(10)16(23)21-13-17(24)22-15(19(25)26)20(2,3)28-18(13)22;/h4-9,13,15,18H,1-3H3,(H,21,23)(H,25,26);/q;+1/p-1/t13-,15+,18-;/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 | C20H19N2O4S2 |
| Molecular Weight | 415.506 |
| 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
Mon Mar 31 17:56:30 GMT 2025
by
admin
on
Mon Mar 31 17:56:30 GMT 2025
|
| Record UNII |
1K9P6L7KZ0
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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24665-15-4
Created by
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1K9P6L7KZ0
Created by
admin on Mon Mar 31 17:56:30 GMT 2025 , Edited by admin on Mon Mar 31 17:56:30 GMT 2025
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133082528
Created by
admin on Mon Mar 31 17:56:30 GMT 2025 , Edited by admin on Mon Mar 31 17:56:30 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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