Structure Information
Structure

Compound Identification

SMILES

OC(=O)CCCCC1=NC(NCC2=CC3=C(OCCO3)C=C2)=C2C(SC3=CC=CC=C23)=N1

InChIKey

InChIKey=PHPLYCRBCTZPMX-UHFFFAOYSA-N

Formula

C24H23N3O4S

Mass

449.53

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzodioxanes

Subclass

Benzo-1,4-dioxanes

Intermediate Tree Nodes

Not available

Direct Parent

Benzo-1,4-dioxanes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzo-1,4-dioxane - 1-benzothiophene - Benzothiophene - Thienopyrimidine - Medium-chain fatty acid - Alkyl aryl ether - Aminopyrimidine - Heterocyclic fatty acid - Para-dioxin - Pyrimidine - Benzenoid - Imidolactam - Fatty acid - Fatty acyl - Thiophene - Heteroaromatic compound - Azacycle - Oxacycle - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Amine - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzo-1,4-dioxanes. These are heterocyclic compounds containing a benzene ring fused to a 1,4-dioxane ring.

External Descriptors

Not available

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