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Structure Information
Structure

Compound Identification

SMILES

CN(C)\C=C(/C(=O)C(Cl)(Cl)Cl)C1=NN=NN1C1=CC=C(Br)C=C1

InChIKey

InChIKey=UBJCLGSOVXEJSV-JXMROGBWSA-N

Formula

C13H11BrCl3N5O

Mass

439.52

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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 - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Alpha-branched alpha,beta-unsaturated-ketone - Acryloyl-group - Alpha-haloketone - Alpha-chloroketone - Enone - Heteroaromatic compound - Alpha,beta-unsaturated ketone - Vinylogous amide - Tertiary aliphatic amine - Tertiary amine - Ketone - Enamine - Azacycle - Organobromide - Organohalogen compound - Alkyl chloride - Organic oxide - Amine - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Alkyl halide - Organochloride - Organonitrogen compound - 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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