Structure Information
Structure

Compound Identification

SMILES

CN(C)C(=O)CC1CN(CCN1C1=NC=C(C=N1)C1=CC=NC=C1)S(=O)(=O)C1=CC2=C(C=C1)C=C(Cl)C=C2

InChIKey

InChIKey=YUBJQDMNQNUKBF-UHFFFAOYSA-N

Formula

C27H27ClN6O3S

Mass

551.06

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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 sulfonic acid or derivatives - Naphthalene sulfonamide - 2-naphthalene sulfonamide - N-arylpiperazine - Chloronaphthalene - Beta amino acid or derivatives - Dialkylarylamine - Aminopyrimidine - Aryl chloride - Aryl halide - 1,4-diazinane - Piperazine - Pyridine - Pyrimidine - Organosulfonic acid amide - Heteroaromatic compound - Tertiary carboxylic acid amide - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Carboxamide group - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organic oxide - 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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