Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C19H17N4O4S.Na |
Molecular Weight | 420.417 |
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=NC=CN=C3C4=CC=CC=C4)C([O-])=O
InChI
InChIKey=ZLPLEFSTUBLHDL-SLINCCQESA-M
InChI=1S/C19H18N4O4S.Na/c1-19(2)14(18(26)27)23-16(25)13(17(23)28-19)22-15(24)12-11(20-8-9-21-12)10-6-4-3-5-7-10;/h3-9,13-14,17H,1-2H3,(H,22,24)(H,26,27);/q;+1/p-1/t13-,14+,17-;/m1./s1
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 | C19H17N4O4S |
Molecular Weight | 397.428 |
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
Fri Dec 15 15:03:04 GMT 2023
by
admin
on
Fri Dec 15 15:03:04 GMT 2023
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Record UNII |
ZGP7Y7UX3A
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Record Status |
Validated (UNII)
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Record Version |
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5893-99-2
Created by
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ZGP7Y7UX3A
Created by
admin on Fri Dec 15 15:03:04 GMT 2023 , Edited by admin on Fri Dec 15 15:03:04 GMT 2023
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133082231
Created by
admin on Fri Dec 15 15:03:04 GMT 2023 , Edited by admin on Fri Dec 15 15:03:04 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |