Structure Information
Structure

Compound Identification

SMILES

O=C(NCC1=CC=CO1)C1=CC2=C(SN=N2)C=C1

InChIKey

InChIKey=HUTQAMYNQHCDFA-UHFFFAOYSA-N

Formula

C12H9N3O2S

Mass

259.28

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzothiadiazoles

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzothiadiazoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1,2,3-benzothiadiazole - Benzenoid - Azole - Furan - Thiadiazole - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Oxacycle - Azacycle - Carboxylic acid derivative - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzothiadiazoles. These are heterocyclic aromatic compounds containing a benzene ring fused to a thiadiazole ring. Thiadiazole is a five-membered aromatic heterocycle made up of one sulfur atom and two nitrogen atoms.

External Descriptors

Not available

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