Structure Information
Structure

Compound Identification

SMILES

CC1=NN(C2=C1[C@@]1(C)CC[C@H](CBr)N1C2=O)C1=CC=C(Cl)C=C1

InChIKey

InChIKey=XEUNAIZHBIRHPX-CXAGYDPISA-N

Formula

C17H17BrClN3O

Mass

394.7

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Pyrazoles

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpyrazoles

Alternative Parents

Pyrrolopyrazoles 2-heteroaryl carboxamides Chlorobenzenes Aryl chlorides Tertiary carboxylic acid amides Pyrrolidines Pyrroles Heteroaromatic compounds Lactams Azacyclic compounds Hydrocarbon derivatives Organic oxides Organobromides Organochlorides Organonitrogen compounds Alkyl bromides Organooxygen compounds

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phenylpyrazole - 2-heteroaryl carboxamide - Pyrrolopyrazole - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Tertiary carboxylic acid amide - Pyrrolidine - Pyrrole - Carboxamide group - Lactam - Carboxylic acid derivative - Azacycle - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Alkyl halide - Alkyl bromide - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organobromide - Organochloride - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpyrazoles. These are compounds containing a phenylpyrazole skeleton, which consists of a pyrazole bound to a phenyl group.

External Descriptors

Not available

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