| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:30:31 UTC |
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| Update Date | 2025-03-21 18:41:37 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00135205 |
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| Frequency | 18.6 |
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| Structure | |
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| Chemical Formula | C9H13N3O2S2 |
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| Molecular Mass | 259.0449 |
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| SMILES | CC(=O)Nc1nc(CSCCC(N)=O)cs1 |
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| InChI Key | KMXRQOATKAPWFI-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic nitrogen compounds |
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| Class | organonitrogen compounds |
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| Subclass | n-arylamides |
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| Direct Parent | n-acetylarylamines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 2,4-disubstituted thiazolesacetamidesazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesdialkylthioethersheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganopnictogen compoundsprimary carboxylic acid amidessecondary carboxylic acid amidessulfenyl compounds |
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| Substituents | primary carboxylic acid amidecarbonyl groupn-acetylarylaminearomatic heteromonocyclic compoundorganosulfur compoundcarboxylic acid derivativeorganic oxideorganopnictogen compoundorganoheterocyclic compoundacetamideazolesulfenyl compoundazacycledialkylthioetherheteroaromatic compoundcarboxamide groupsecondary carboxylic acid amideorganic oxygen compoundthioether2,4-disubstituted 1,3-thiazolehydrocarbon derivativethiazoleorganooxygen compound |
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