Compound Identification
SMILES
[Cs+].CC(C)CN([C@@H](CCCCNC(=O)CCC1=CNC2=CC=CC=C12)C([O-])=O)S(=O)(=O)C1=CC=C(C)C=C1
InChIKey
InChIKey=HQFIZFMPAVDUHQ-SNYZSRNZSA-M
Formula
C28H36CsN3O5S
Mass
659.58
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
-
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
Tryptamines and derivatives Benzenesulfonamides 3-alkylindoles Alpha amino acids and derivatives Benzenesulfonyl compounds Medium-chain fatty acids Substituted pyrroles Fatty amides Organosulfonamides Heteroaromatic compounds Aminosulfonyl compounds Carboxylic acid salts Secondary carboxylic acid amides Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Organic alkali metal salts Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic zwitterions Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N,n-disubstituted p-toluenesulfonamide - Triptan - Alpha-amino acid or derivatives - Benzenesulfonamide - 3-alkylindole - Indole - Benzenesulfonyl group - Indole or derivatives - Medium-chain fatty acid - Fatty amide - Substituted pyrrole - Organosulfonic acid amide - Fatty acid - Fatty acyl - Pyrrole - Aminosulfonyl compound - Organic sulfonic acid or derivatives - Heteroaromatic compound - Sulfonyl - Organosulfonic acid or derivatives - Carboxamide group - Carboxylic acid salt - Secondary carboxylic acid amide - Organoheterocyclic compound - Organic alkali metal salt - Azacycle - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organic zwitterion - Organic salt - Organosulfur 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