Structure Information
Structure

Compound Identification

SMILES

COC1=CC(CN2N=C(C3=CC=CS3)C(CC3=CC4=NSN=C4C=C3)=C2OC=O)=CC(OC)=C1OC

InChIKey

InChIKey=UVDHTRXYBBVDJU-UHFFFAOYSA-N

Formula

C25H22N4O5S2

Mass

522.59

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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

2,1,3-benzothiadiazole - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - Thiophene - Thiadiazole - Pyrazole - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Organonitrogen 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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