Structure Information
Structure

Compound Identification

SMILES

CC1=C(Br)C=C2C(=O)C(CN3CCCC3)(COC2=C1Br)SC1=CC=C(Cl)C=C1

InChIKey

InChIKey=AASWSEZXDHTOEA-UHFFFAOYSA-N

Formula

C21H20Br2ClNO2S

Mass

545.71

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzopyrans

Subclass

1-benzopyrans

Intermediate Tree Nodes

Not available

Direct Parent

Chromones

Alternative Parents

Thiophenol ethers Aryl alkyl ketones Alkyl aryl ethers Alkylarylthioethers Chlorobenzenes Aryl bromides Aryl chlorides N-alkylpyrrolidines Trialkylamines Azacyclic compounds Sulfenyl compounds Oxacyclic compounds Hydrocarbon derivatives Organochlorides Organic oxides Organobromides

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Chromone - Aryl thioether - Aryl alkyl ketone - Aryl ketone - Thiophenol ether - Alkyl aryl ether - Chlorobenzene - Alkylarylthioether - Halobenzene - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - N-alkylpyrrolidine - Pyrrolidine - Tertiary amine - Tertiary aliphatic amine - Ketone - Thioether - Oxacycle - Azacycle - Sulfenyl compound - Ether - Organic nitrogen compound - Organohalogen compound - Organobromide - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as chromones. These are compounds containing a benzopyran-4-one moiety.

External Descriptors

Not available

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