Compound Identification
SMILES
CCO\C(=N\S(=O)(=O)C1=CC=C(C)C=C1)[C@@H](Br)[C@@H]1N([C@@]1(Br)C(=O)C1=CC=C(Cl)C=C1)S(=O)(=O)C1=CC=C(C)C=C1
InChIKey
InChIKey=HMRVGTLXYHJXAN-DBIACPNNSA-N
Formula
C27H25Br2ClN2O6S2
Mass
732.88
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
Alkyl-phenylketones Benzenesulfonamides Benzenesulfonyl compounds Aryl alkyl ketones Benzoyl derivatives Chlorobenzenes Organosulfonamides Aryl chlorides Sulfonyls Alpha-haloketones Aziridines Azacyclic compounds Organobromides Organochlorides Organonitrogen compounds Alkyl bromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N,n-disubstituted p-toluenesulfonamide - Alkyl-phenylketone - Benzenesulfonamide - Phenylketone - Benzenesulfonyl group - Benzoyl - Aryl alkyl ketone - Aryl ketone - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Organosulfonic acid amide - Alpha-haloketone - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Ketone - Organoheterocyclic compound - Aziridine - Azacycle - Alkyl bromide - Organobromide - Organohalogen compound - Organochloride - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Alkyl halide - Organosulfur 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