Structure Information
Structure

Compound Identification

SMILES

ClC1=CC=CC=C1N1N=NN=C1SCC1=C(Cl)C=CC(C(=O)OC2=CC(=O)CCC2)=C1Cl

InChIKey

InChIKey=GKVWKFNZKIJSMC-UHFFFAOYSA-N

Formula

C21H15Cl3N4O3S

Mass

509.79

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Tetrazoles

Intermediate Tree Nodes

Not available

Direct Parent

Phenyltetrazoles and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenyltetrazole - 2-halobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoate ester - Benzoic acid or derivatives - Aryl thioether - 1,3-dichlorobenzene - Benzoyl - Halobenzene - Cyclohexenone - Chlorobenzene - Alkylarylthioether - Monocyclic benzene moiety - Aryl chloride - Benzenoid - Aryl halide - Heteroaromatic compound - Enol ester - Vinylogous halide - Cyclic ketone - Carboxylic acid ester - Ketone - Thioether - Sulfenyl compound - Carboxylic acid derivative - Azacycle - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenyltetrazoles and derivatives. These are compounds containing a phenyltetrazole skeleton, which consists of a tetrazole bound to a phenyl group.

External Descriptors

Not available

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