Compound Identification
SMILES
CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N1CCN(CC1)C1=CC(Cl)=CC=C1)C1=CC=C(F)C=C1
InChIKey
InChIKey=GVQLVFOQHRDBSS-UHFFFAOYSA-N
Formula
C25H25ClFN3O3S
Mass
502.0
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Toluenes
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Level 5
Tosyl compounds
- Level 6 P-toluenesulfonamides
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Level 5
Tosyl compounds
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Subclass
Toluenes
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Toluenes
Intermediate Tree Nodes
Tosyl compounds - P-toluenesulfonamides
Direct Parent
N,N-disubstituted p-toluenesulfonamides
Alternative Parents
Phenylpiperazines N-arylpiperazines Sulfanilides Alpha amino acids and derivatives Benzenesulfonamides Benzenesulfonyl compounds Aniline and substituted anilines Dialkylarylamines Fluorobenzenes Chlorobenzenes Organosulfonamides Aryl chlorides Aryl fluorides Tertiary carboxylic acid amides Aminosulfonyl compounds Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organofluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N,n-disubstituted p-toluenesulfonamide - Phenylpiperazine - N-arylpiperazine - Alpha-amino acid or derivatives - Sulfanilide - Benzenesulfonamide - Benzenesulfonyl group - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - Dialkylarylamine - Halobenzene - Fluorobenzene - Chlorobenzene - Aryl chloride - Aryl halide - Aryl fluoride - Piperazine - 1,4-diazinane - Organosulfonic acid amide - Aminosulfonyl compound - Tertiary carboxylic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Amino acid or derivatives - Carboxamide group - Tertiary amine - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organic oxygen compound - Organic nitrogen compound - Amine - Organohalogen compound - Organochloride - Carbonyl group - Organofluoride - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organosulfur compound - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n,n-disubstituted p-toluenesulfonamides. These are p-toluenesulfonamide derivatives in which the sulfonamide moiety is N,N-disubstituted.
External Descriptors
Not available