Compound Identification
SMILES
CN1C(=NC=C1[N+]([O-])=O)N1CCN(C1=O)C1=NN=CS1
InChIKey
InChIKey=WWRHIPHGZXBHDQ-UHFFFAOYSA-N
Formula
C9H9N7O3S
Mass
295.28
Taxonomic Classification
Taxonomy Tree
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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
Thiadiazoles
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Level 5
Aminothiadiazoles
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Level 6
2-amino-1,3,4-thiadiazoles
- Level 7 1,3,4-thiadiazol-2-ylureas
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Level 6
2-amino-1,3,4-thiadiazoles
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Level 5
Aminothiadiazoles
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Subclass
Thiadiazoles
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Class
Azoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Thiadiazoles
Intermediate Tree Nodes
Aminothiadiazoles - 2-amino-1,3,4-thiadiazoles
Direct Parent
1,3,4-thiadiazol-2-ylureas
Alternative Parents
1,2,5-trisubstituted imidazoles Nitroimidazoles Nitroaromatic compounds Imidazolidinones N-substituted imidazoles Heteroaromatic compounds Ureas Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organonitrogen compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds Organic salts Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1,3,4-thiadiazol-2-ylurea - 1,2,5-trisubstituted-imidazole - Nitroaromatic compound - Nitroimidazole - Trisubstituted imidazole - Imidazolidinone - N-substituted imidazole - Imidazole - Imidazolidine - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Urea - Organic oxoazanium - Azacycle - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carbonyl group - Organic salt - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 1,3,4-thiadiazol-2-ylureas. These are aromatic compounds containing a 1,3,4-thiadiazole ring, which is substituted at the 2-position with urea.
External Descriptors
Not available