Compound Identification
SMILES
CCN(CC)S(=O)(=O)C1=CC(C(=O)NC[C@@H]([NH+]2CCCC2)C2=CC=CS2)=C(C)C=C1
InChIKey
InChIKey=MDTURQXIKMTUES-HXUWFJFHSA-O
Formula
C22H32N3O3S2
Mass
450.64
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
Benzenesulfonamides o-Toluamides Benzamides Benzenesulfonyl compounds Benzoyl derivatives Aralkylamines Organosulfonamides N-alkylpyrrolidines Heteroaromatic compounds Aminosulfonyl compounds Quaternary ammonium salts Thiophenes Trialkylamines Secondary carboxylic acid amides Azacyclic compounds Hydrocarbon derivatives Organic oxides Organooxygen compounds Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N,n-disubstituted p-toluenesulfonamide - Benzenesulfonamide - Benzamide - Benzoic acid or derivatives - Benzenesulfonyl group - O-toluamide - Toluamide - Benzoyl - Aralkylamine - N-alkylpyrrolidine - Organosulfonic acid amide - Pyrrolidine - Quaternary ammonium salt - Aminosulfonyl compound - Thiophene - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - Tertiary aliphatic amine - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organosulfur compound - Organic nitrogen compound - Organic cation - 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