Structure Information
Structure

Compound Identification

SMILES

COC1=C(Br)C2=CC=CC=C2C=C1C(=O)NC1=NC(=CS1)C1=CC=CC=C1

InChIKey

InChIKey=HTJLTVKTXVAIRX-UHFFFAOYSA-N

Formula

C21H15BrN2O2S

Mass

439.33

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Naphthalenes

Subclass

Naphthalenecarboxylic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Naphthalenecarboxamides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

2-naphthalenecarboxamide - Halobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Anisole - Phenol ether - 2,4-disubstituted 1,3-thiazole - Alkyl aryl ether - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Azole - Thiazole - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organobromide - Organohalogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as naphthalenecarboxamides. These are compounds containing a naphthalene moiety, which bears a carboxylic acid amide group at one or more positions. Naphthalene is a bicyclic compound that is made up of two fused benzene rings.

External Descriptors

Not available

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