Compound Identification
SMILES
CCOC(=O)N1CCN(CC1)C(=O)C1=CC=C(CNS(=O)(=O)C2=CC=C(C)C=C2)C=C1
InChIKey
InChIKey=JJAQXWFXURRJFN-UHFFFAOYSA-N
Formula
C22H27N3O5S
Mass
445.53
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
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Class
Benzene and substituted derivatives
-
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
Direct Parent
P-toluenesulfonamides
Alternative Parents
Benzenesulfonamides Piperazine carboxylic acids Benzenesulfonyl compounds Benzamides Benzoyl derivatives Organosulfonamides Tertiary carboxylic acid amides Carbamate esters Aminosulfonyl compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
P-toluenesulfonamide - Benzenesulfonamide - Benzamide - Benzoic acid or derivatives - Benzenesulfonyl group - Piperazine-1-carboxylic acid - Benzoyl - Piperazine - Organosulfonic acid amide - 1,4-diazinane - Tertiary carboxylic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Carbamic acid ester - Aminosulfonyl compound - Organic sulfonic acid or derivatives - Carboxamide group - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteromonocyclic 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