Structure Information
Structure

Compound Identification

SMILES

CC1CCCCN1C1=NN=C(NC(=O)C2=NOC(=C2)C2=CC=C(Br)C=C2)S1

InChIKey

InChIKey=YWDBPOCLUIMCRE-UHFFFAOYSA-N

Formula

C18H18BrN5O2S

Mass

448.34

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Subclass

Carboxylic acid derivatives

Intermediate Tree Nodes

Carboxylic acid amides

Direct Parent

2-heteroaryl carboxamides

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

2-heteroaryl carboxamide - Dialkylarylamine - Bromobenzene - Halobenzene - 2-amino-5-substituted-1,3,4-thiadiazole - 2-amino-1,3,4-thiadiazole - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Piperidine - Benzenoid - Azole - Thiadiazole - Heteroaromatic compound - Isoxazole - Secondary carboxylic acid amide - Oxacycle - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Organobromide - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as 2-heteroaryl carboxamides. These are compounds containing a heteroaromatic ring that carries a carboxamide group.

External Descriptors

Not available

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