Compound Identification
SMILES
CC1=C2CCN(C3=C(C=CC=N3)C2=NN1C1=CC(Cl)=C(C)C=C1)S(=O)(=O)C1=CC=C(C)C=C1
InChIKey
InChIKey=BCKBPOGEIKJCSY-UHFFFAOYSA-N
Formula
C25H23ClN4O2S
Mass
479.0
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
-
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
Pyrazolylpyridines Phenylpyrazoles Benzenesulfonamides Benzenesulfonyl compounds Azepines Chlorobenzenes Aryl chlorides Organosulfonamides Imidolactams Heteroaromatic compounds Sulfonyls Azacyclic compounds Organochlorides Organonitrogen compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N,n-disubstituted p-toluenesulfonamide - Phenylpyrazole - 3-pyrazolylpyridine - Benzenesulfonamide - Benzenesulfonyl group - Azepine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Pyridine - Organosulfonic acid amide - Imidolactam - Azole - Sulfonyl - Organosulfonic acid or derivatives - Heteroaromatic compound - Pyrazole - Organic sulfonic acid or derivatives - Organoheterocyclic compound - Azacycle - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic 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