Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C19H18N3O5S.Na.H2O |
| Molecular Weight | 441.433 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.[Na+].[H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)C3=C(C)ON=C3C4=CC=CC=C4)C([O-])=O
InChI
InChIKey=ZVIYWUUZWWBNMB-VICXVTCVSA-M
InChI=1S/C19H19N3O5S.Na.H2O/c1-9-11(12(21-27-9)10-7-5-4-6-8-10)15(23)20-13-16(24)22-14(18(25)26)19(2,3)28-17(13)22;;/h4-8,13-14,17H,1-3H3,(H,20,23)(H,25,26);;1H2/q;+1;/p-1/t13-,14+,17-;;/m1../s1
Approval Year
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NCI_THESAURUS |
C1500
Created by
admin on Fri Dec 15 14:57:38 UTC 2023 , Edited by admin on Fri Dec 15 14:57:38 UTC 2023
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7810
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G0V6C994Q5
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23694213
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100000136828
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G0V6C994Q5
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9898
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1481000
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SUB75010
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C720
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DBSALT000248
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7240-38-2
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757253
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SUB03559MIG
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m8273
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CHEMBL819
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DTXSID50273924
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ACTIVE MOIETY
SUBSTANCE RECORD