Structure Information
Structure

Compound Identification

SMILES

CC(F)CNCC1=CC(F)=C(C=C1)C1=NN=C(O1)C1=NC(=CN=C1N)C1=CC=C(C=C1)S(=O)(=O)C(C)CCO

InChIKey

InChIKey=LDRPLIKULAKDFJ-UHFFFAOYSA-N

Formula

C26H28F2N6O4S

Mass

558.6

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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 heteromonocyclic compounds

Substituents

Benzenesulfonyl group - Benzylamine - Phenylmethylamine - Aminopyrazine - Fluorobenzene - Halobenzene - Aralkylamine - Aryl fluoride - Aryl halide - Pyrazine - Imidolactam - 1,3,4-oxadiazole - Azole - Heteroaromatic compound - Oxadiazole - Sulfone - Sulfonyl - Azacycle - Secondary amine - Organoheterocyclic compound - Secondary aliphatic amine - Oxacycle - Organic nitrogen compound - Organofluoride - Organohalogen compound - Organonitrogen compound - Alkyl fluoride - Organooxygen compound - Hydrocarbon derivative - Alcohol - Organic oxide - Organic oxygen compound - Primary alcohol - Primary amine - Organosulfur compound - Alkyl halide - Amine - Aromatic heteromonocyclic 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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