Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC(OC)=C1C(=O)N1CCN(CC2=NN=NN2C2=CC=C(Cl)C=C2)CC1

InChIKey

InChIKey=XTVAXLBGXLVOJH-UHFFFAOYSA-N

Formula

C21H23ClN6O3

Mass

442.9

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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 - Dimethoxybenzene - M-dimethoxybenzene - Benzamide - Benzoic acid or derivatives - Anisole - Phenoxy compound - Benzoyl - Phenol ether - Methoxybenzene - Aralkylamine - Chlorobenzene - N-alkylpiperazine - Halobenzene - Alkyl aryl ether - Benzenoid - 1,4-diazinane - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Piperazine - Tertiary carboxylic acid amide - Heteroaromatic compound - Carboxamide group - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid derivative - Ether - Azacycle - Organic oxygen compound - Amine - Organohalogen compound - Organic nitrogen compound - Organochloride - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen 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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