Structure Information
Structure

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

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Taxonomic Classification

Taxonomy Tree

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

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

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