Structure Information
Structure

Compound Identification

SMILES

ClC1=CC=CC=C1C1=NC2=C(Br)C=NN2C(NCCCNS(=O)(=O)C2=CC=CC3=CC=CC=C23)=C1

InChIKey

InChIKey=RDCLTZLFGHLMPE-UHFFFAOYSA-N

Formula

C25H21BrClN5O2S

Mass

570.89

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Naphthalenes

Subclass

Naphthalene sulfonic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

1-naphthalene sulfonic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-naphthalene sulfonamide - Naphthalene sulfonamide - 1-naphthalene sulfonic acid or derivatives - 4-phenylpyrimidine - Pyrazolo[1,5-a]pyrimidine - Pyrazolopyrimidine - Aminopyrimidine - Chlorobenzene - Halobenzene - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyrimidine - Organosulfonic acid amide - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Pyrazole - Heteroaromatic compound - Aminosulfonyl compound - Sulfonyl - Azole - Organoheterocyclic compound - Azacycle - Organic nitrogen compound - Organobromide - Organohalogen compound - Organopnictogen compound - Organic oxygen compound - Amine - Organochloride - Organonitrogen compound - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1-naphthalene sulfonic acids and derivatives. These are organic aromatic compounds that contain a naphthalene moiety that carries a sulfonic acid group (or a derivative thereof) at the 1-position. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.

External Descriptors

Not available

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