Structure Information
Structure

Compound Identification

SMILES

CC1=CC=C(\C=C2/SC(=O)N(CCNC(=O)C3=CC(=CC=C3)N3C=NN=N3)C2=O)C=C1

InChIKey

InChIKey=KITJECDQMBLVJS-WQRHYEAKSA-N

Formula

C21H18N6O3S

Mass

434.47

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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 - Benzamide - Benzoic acid or derivatives - Benzoyl - Toluene - Thiazolidinedione - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Thiazolidine - Dicarboximide - Thiocarbamic acid derivative - Tertiary amine - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organonitrogen compound - Carbonyl group - Amine - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Organic oxide - 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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