Structure Information
Structure

Compound Identification

SMILES

CC1=C(C=C(Cl)C=C1)N1C(SCC2=CC=C(F)C=C2)=NN=C1C(CC1=CC=CC=C1)NS(=O)(=O)C1=CC2=CC=CC=C2C=C1

InChIKey

InChIKey=WMTYSAVRRBFVQQ-UHFFFAOYSA-N

Formula

C34H28ClFN4O2S2

Mass

643.19

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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

2-naphthalene sulfonic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

2-naphthalene sulfonamide - Naphthalene sulfonamide - 2-naphthalene sulfonic acid or derivatives - Phenyltriazole - Phenyl-1,2,4-triazole - Amphetamine or derivatives - Aryl thioether - Chlorobenzene - Fluorobenzene - Halobenzene - Toluene - Alkylarylthioether - Aryl halide - Aryl fluoride - Monocyclic benzene moiety - Organosulfonic acid amide - Aryl chloride - Heteroaromatic compound - Azole - Aminosulfonyl compound - 1,2,4-triazole - Triazole - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Organoheterocyclic compound - Azacycle - Sulfenyl compound - Thioether - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 2-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 2-position. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.

External Descriptors

Not available

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