| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:49:30 UTC |
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| Update Date | 2025-03-25 00:49:54 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02177396 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H13N3O2S |
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| Molecular Mass | 287.0728 |
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| SMILES | Cc1ccc(S(=O)(=O)Nc2nc3ccccc3[nH]2)cc1 |
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| InChI Key | MKEQVJOEZCTECE-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | benzene and substituted derivatives |
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| Subclass | toluenes |
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| Direct Parent | p-toluenesulfonamides |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | aminosulfonyl compoundsazacyclic compoundsbenzenesulfonamidesbenzenesulfonyl compoundsbenzimidazolesheteroaromatic compoundshydrocarbon derivativesimidazolesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsorganosulfonamides |
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| Substituents | organosulfonic acid or derivativesorganosulfur compoundorganosulfonic acid amideorganic oxidearomatic heteropolycyclic compoundbenzimidazoleimidazoleorganonitrogen compoundorganopnictogen compoundorganoheterocyclic compoundazolebenzenesulfonyl groupbenzenesulfonamideazacycleaminosulfonyl compoundp-toluenesulfonamideheteroaromatic compoundsulfonylorganic oxygen compoundorganic sulfonic acid or derivativeshydrocarbon derivativeorganic nitrogen compound |
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