Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C12H9N2O3S.Na.H2O |
| Molecular Weight | 302.282 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.[Na+].CSC1=CC2=C(C=C1)N=CN(\C=C\C([O-])=O)C2=O
InChI
InChIKey=HVCXVHOWMRZPBE-SFKRKKMESA-M
InChI=1S/C12H10N2O3S.Na.H2O/c1-18-8-2-3-10-9(6-8)12(17)14(7-13-10)5-4-11(15)16;;/h2-7H,1H3,(H,15,16);;1H2/q;+1;/p-1/b5-4+;;
Approval Year
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C29578
Created by
admin on Fri Dec 15 15:16:22 UTC 2023 , Edited by admin on Fri Dec 15 15:16:22 UTC 2023
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| Code System | Code | Type | Description | ||
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CHEMBL337379
Created by
admin on Fri Dec 15 15:16:22 UTC 2023 , Edited by admin on Fri Dec 15 15:16:22 UTC 2023
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23675014
Created by
admin on Fri Dec 15 15:16:22 UTC 2023 , Edited by admin on Fri Dec 15 15:16:22 UTC 2023
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AA-39
Created by
admin on Fri Dec 15 15:16:22 UTC 2023 , Edited by admin on Fri Dec 15 15:16:22 UTC 2023
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C72862
Created by
admin on Fri Dec 15 15:16:22 UTC 2023 , Edited by admin on Fri Dec 15 15:16:22 UTC 2023
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4PG8A6UTDX
Created by
admin on Fri Dec 15 15:16:22 UTC 2023 , Edited by admin on Fri Dec 15 15:16:22 UTC 2023
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111868-63-4
Created by
admin on Fri Dec 15 15:16:22 UTC 2023 , Edited by admin on Fri Dec 15 15:16:22 UTC 2023
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PRIMARY |
ACTIVE MOIETY
SUBSTANCE RECORD
