| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 01:46:33 UTC |
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| Update Date | 2025-03-21 20:03:00 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00311456 |
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| Frequency | 6.3 |
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| Structure | |
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| Chemical Formula | C5H5N3S |
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| Molecular Mass | 139.0204 |
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| SMILES | S=C=NCc1cnc[nH]1 |
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| InChI Key | OYGRCZDEMKLVQQ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | azoles |
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| Subclass | imidazoles |
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| Direct Parent | imidazoles |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesisothiocyanatesorganonitrogen compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compounds |
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| Substituents | isothiocyanatearomatic heteromonocyclic compoundazacycleheteroaromatic compoundorganic 1,3-dipolar compoundorganosulfur compoundpropargyl-type 1,3-dipolar organic compoundimidazoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compound |
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