| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:50:01 UTC |
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| Update Date | 2025-03-25 00:50:04 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02178566 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H9NS |
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| Molecular Mass | 163.0456 |
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| SMILES | c1ccc(C2=NCSC2)cc1 |
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| InChI Key | FIDSSPUKKQZCIB-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 | benzene and substituted derivatives |
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| Direct Parent | benzene and substituted derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsdialkylthioethershydrocarbon derivativesketiminesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundsthiazolines |
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| Substituents | ketiminemonocyclic benzene moietymeta-thiazolinearomatic heteromonocyclic compoundazacycleiminedialkylthioetherorganic 1,3-dipolar compoundpropargyl-type 1,3-dipolar organic compoundthioetherorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compound |
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