Structure Information
Structure

Compound Identification

SMILES

BrC1=CC2=C(C=C1)N(CC#C)C(S2)=NC(=O)C1=CC2=C(OCCO2)C=C1

InChIKey

InChIKey=CXPLWLPNWOBXJJ-UHFFFAOYSA-N

Formula

C19H13BrN2O3S

Mass

429.29

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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 - 1,3-benzothiazole - Alkyl aryl ether - Benzenoid - Para-dioxin - Heteroaromatic compound - Meta-thiazoline - Thiazole - Azole - N-acylimine - Isothiourea - Haloacetylene or derivatives - Acetylide - Oxacycle - Azacycle - Bromoalkene - Haloalkene - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Carboximidamide - Vinyl halide - Vinyl bromide - Ether - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen 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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