Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C19H18N3O4S2.Na |
Molecular Weight | 439.484 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 3 / 3 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].[H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)C3=C(C)SN=C3C4=CC=CC=C4)C([O-])=O
InChI
InChIKey=NKHGALILKMHPKL-SLINCCQESA-M
InChI=1S/C19H19N3O4S2.Na/c1-9-11(12(21-28-9)10-7-5-4-6-8-10)15(23)20-13-16(24)22-14(18(25)26)19(2,3)27-17(13)22;/h4-8,13-14,17H,1-3H3,(H,20,23)(H,25,26);/q;+1/p-1/t13-,14+,17-;/m1./s1
Molecular Formula | C19H18N3O4S2 |
Molecular Weight | 416.494 |
Charge | -1 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 3 / 3 |
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 15:48:58 GMT 2023
by
admin
on
Fri Dec 15 15:48:58 GMT 2023
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Record UNII |
B9K2FB3W2X
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Record Status |
Validated (UNII)
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Record Version |
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-
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133082630
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B9K2FB3W2X
Created by
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16216-98-1
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admin on Fri Dec 15 15:48:58 GMT 2023 , Edited by admin on Fri Dec 15 15:48:58 GMT 2023
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DTXSID90635380
Created by
admin on Fri Dec 15 15:48:58 GMT 2023 , Edited by admin on Fri Dec 15 15:48:58 GMT 2023
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Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
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