Compound Identification
SMILES
CCCNC1=NC2=C(C=C(CCN2S(=O)(=O)C2=CC=C(C)C=C2)C(=O)OC)C(=O)N1C1=CC=CC=C1
InChIKey
InChIKey=CNODRWAAYPHKFH-UHFFFAOYSA-N
Formula
C26H28N4O5S
Mass
508.59
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 Benzenesulfonyl compounds Aminopyrimidines and derivatives Azepines Secondary alkylarylamines Pyrimidones Organosulfonamides Imidolactams Methyl esters Vinylogous amides Heteroaromatic compounds Enoate esters Sulfonyls Lactams Amino acids and derivatives Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Carbonyl compounds Organopnictogen compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N,n-disubstituted p-toluenesulfonamide - Benzenesulfonamide - Benzenesulfonyl group - Aminopyrimidine - Azepine - Secondary aliphatic/aromatic amine - Pyrimidone - Organosulfonic acid amide - Imidolactam - Pyrimidine - Vinylogous amide - Organosulfonic acid or derivatives - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Organic sulfonic acid or derivatives - Sulfonyl - Heteroaromatic compound - Amino acid or derivatives - Carboxylic acid ester - Lactam - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Azacycle - Secondary amine - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Amine - Carbonyl group - Organopnictogen 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