Compound Identification
SMILES
CCOC(=O)C1=C(NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C2=CC=C(C)C=C2)SC2=C1CCC(C)C2
InChIKey
InChIKey=FBTIJAAXOZSZLP-UHFFFAOYSA-N
Formula
C27H28N4O4S2
Mass
536.67
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
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
Direct Parent
P-toluenesulfonamides
Alternative Parents
Quinoxalines Benzenesulfonamides 3,4,5-trisubstituted-2-aminothiophenes Benzenesulfonyl compounds Thiophene carboxylic acids and derivatives N-arylated-2-aminothiophenes Aminopyrazines Organosulfonamides Imidolactams Vinylogous amides Heteroaromatic compounds Aminosulfonyl compounds Amino acids and derivatives Carboxylic acid esters Secondary amines Azacyclic compounds Hydrocarbon derivatives Organic oxides Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
P-toluenesulfonamide - Benzenesulfonamide - Quinoxaline - Benzenesulfonyl group - 3,4,5-trisubstituted-2-aminothiophene - Thiophene carboxylic acid or derivatives - Aminopyrazine - N-arylated-2-aminothiophene - Pyrazine - Organosulfonic acid amide - 2-aminothiophene - Imidolactam - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Thiophene - Aminosulfonyl compound - Vinylogous amide - Amino acid or derivatives - Carboxylic acid ester - Azacycle - Secondary amine - Carboxylic acid derivative - Organoheterocyclic compound - Amine - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as p-toluenesulfonamides. These are aromatic heterocyclic compounds containing a toluene that is p-substituted with a sulfonamide group.
External Descriptors
Not available