| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:41:26 UTC |
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| Update Date | 2025-03-25 00:47:02 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02158958 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C5H5N3S2 |
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| Molecular Mass | 170.9925 |
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| SMILES | S=C=NCc1c[nH]c(=S)[nH]1 |
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| InChI Key | POHVQABAZJQNED-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 | azolines |
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| Subclass | imidazolines |
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| Direct Parent | imidazolethiones |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazolesisothiocyanatesorganonitrogen compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundsthioureas |
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| Substituents | isothiocyanatethioureaaromatic heteromonocyclic compoundazacycleheteroaromatic compoundimidazole-2-thioneorganic 1,3-dipolar compoundorganosulfur compoundpropargyl-type 1,3-dipolar organic compoundimidazoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundazole |
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