Structure Information
Structure

Compound Identification

SMILES

CC(=O)NCC1=CC=C(S1)C(=O)CSC1=NN=NN1C1=CC(C)=C(C)C=C1

InChIKey

InChIKey=HQMYXKVCNZERCC-UHFFFAOYSA-N

Formula

C18H19N5O2S2

Mass

401.5

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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

o-Xylenes Aryl alkyl ketones Alkylarylthioethers 2,5-disubstituted thiophenes Heteroaromatic compounds Acetamides Secondary carboxylic acid amides Sulfenyl compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenyltetrazole - Aryl thioether - O-xylene - Xylene - Aryl ketone - Aryl alkyl ketone - 2,5-disubstituted thiophene - Alkylarylthioether - Monocyclic benzene moiety - Benzenoid - Thiophene - Heteroaromatic compound - Acetamide - Secondary carboxylic acid amide - Ketone - Carboxamide group - Sulfenyl compound - Thioether - Carboxylic acid derivative - Azacycle - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - 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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