Structure Information
Structure

Compound Identification

SMILES

COCCC(CCOC)S(=O)(=O)C1=CC=C(NC2=NC3=NC=C(C#N)C(NC4=CC(Cl)=C(F)C=C4)=C3S2)C=C1

InChIKey

InChIKey=RMOKRFIGJYKHBC-UHFFFAOYSA-N

Formula

C26H25ClFN5O4S2

Mass

590.09

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzenesulfonyl compounds

Intermediate Tree Nodes

Not available

Direct Parent

Benzenesulfonyl compounds

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzenesulfonyl group - Aniline or substituted anilines - Aminopyridine - Halobenzene - Fluorobenzene - Chlorobenzene - Primary aromatic amine - Pyridine - Aryl chloride - Aryl fluoride - Aryl halide - 1,3-thiazol-2-amine - Sulfone - Sulfonyl - Thiazole - Azole - Heteroaromatic compound - Azacycle - Dialkyl ether - Ether - Organoheterocyclic compound - Secondary amine - Carbonitrile - Nitrile - Organic oxide - Cyanide - Organic oxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzenesulfonyl compounds. These are aromatic compounds containing a benzenesulfonyl group, which consists of a monocyclic benzene moiety that carries a sulfonyl group.

External Descriptors

Not available

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