Structure Information
Structure

Compound Identification

SMILES

CC1=C(C)C(=O)N2NC(NC(=O)C3=CC=C(Cl)C=C3)=NC2=N1

InChIKey

InChIKey=GNRSYQZMFBTWJC-UHFFFAOYSA-N

Formula

C14H12ClN5O2

Mass

317.73

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Halobenzoic acids and derivatives

Direct Parent

4-halobenzoic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

4-halobenzoic acid or derivatives - Triazolopyrimidine - Benzamide - Benzoyl - Halobenzene - Chlorobenzene - Pyrimidone - Aryl halide - Aryl chloride - Pyrimidine - 1,2,4-triazole - Triazole - Azole - Heteroaromatic compound - Secondary carboxylic acid amide - Lactam - Carboxamide group - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 4-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 4-position of the benzene ring.

External Descriptors

Not available

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