Structure Information
Structure

Compound Identification

SMILES

CCC1(C)OC2=CC=CC=C2C(=O)C11SC(=NN1C1=CC(Cl)=CC=C1)C1=CC=CC=C1

InChIKey

InChIKey=HTYJJIWEFRDRES-UHFFFAOYSA-N

Formula

C25H21ClN2O2S

Mass

448.97

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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

Aryl alkyl ketones Chlorobenzenes Alkyl aryl ethers Aryl chlorides Thiadiazolines Oxacyclic compounds Hydrazones Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Chromone - Aryl ketone - Aryl alkyl ketone - Chlorobenzene - Halobenzene - Alkyl aryl ether - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Thiadiazoline - Ketone - Hydrazone - Oxacycle - Ether - Azacycle - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - 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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