| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:59:19 UTC |
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| Update Date | 2025-03-25 00:53:27 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02199709 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6Cl2N2S |
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| Molecular Mass | 201.9159 |
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| SMILES | N#Cc1sc(Cl)c(C#N)c1Cl |
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| InChI Key | TZBSTTZYQHGEQL-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organohalogen compounds |
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| Class | aryl halides |
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| Subclass | aryl chlorides |
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| Direct Parent | aryl chlorides |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | heteroaromatic compoundshydrocarbon derivativesnitrilesorganochloridesorganonitrogen compoundsorganopnictogen compoundsthiophenes |
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| Substituents | aryl chloridenitrilearomatic heteromonocyclic compoundorganochlorideheteroaromatic compoundthiopheneorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundcarbonitrileorganoheterocyclic compound |
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