Structure Information
Structure

Compound Identification

SMILES

CCCSC1=CC(NCCOC(C)=O)=C(C2=NON=C12)[N+]([O-])=O

InChIKey

InChIKey=RTMGFPKMRPKUOS-UHFFFAOYSA-N

Formula

C13H16N4O5S

Mass

340.35

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzoxadiazoles

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzoxadiazoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzoxadiazole - Aryl thioether - Nitroaromatic compound - Thiophenol ether - Alkylarylthioether - Secondary aliphatic/aromatic amine - Benzenoid - Azole - Furazan - Heteroaromatic compound - Oxadiazole - Amino acid or derivatives - Carboxylic acid ester - C-nitro compound - Organic nitro compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Azacycle - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Secondary amine - Thioether - Allyl-type 1,3-dipolar organic compound - Sulfenyl compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organopnictogen compound - Carbonyl group - Amine - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organic zwitterion - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzoxadiazoles. These are organic compounds containing a benzene fused to an oxadiazole ring (a five-membered ring with two carbon atoms, one nitrogen atom, and one oxygen atom).

External Descriptors

Not available

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