Structure Information
Structure

Compound Identification

SMILES

C[C@@H](SC1=NN=NN1C1=CC=C(C)C=C1)C(=O)N(CCC#N)C1=CC=C(C)C=C1

InChIKey

InChIKey=FECAGNBOAHSYMB-QGZVFWFLSA-N

Formula

C21H22N6OS

Mass

406.51

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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 - Anilide - Aryl thioether - Alkylarylthioether - Toluene - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Tertiary amine - Carboxylic acid derivative - Carbonitrile - Nitrile - Azacycle - Thioether - Sulfenyl compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Amine - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Cyanide - 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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