Compound Identification
SMILES
CC(C)CN([C@@H](CCCCNC(=S)[C@H](CC1=CNC2=CC=CC=C12)NS(=O)(=O)C1=CC=C(C)C=C1)C(O)=O)S(=O)(=O)C1=CC=C(C)C=C1
InChIKey
InChIKey=UHQQVUJMYPPPIK-LQJZCPKCSA-N
Formula
C35H44N4O6S3
Mass
712.94
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Toluenes
-
Level 5
Tosyl compounds
- Level 6 P-toluenesulfonamides
-
Level 5
Tosyl compounds
-
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 3-alkylindoles Alpha amino acids and derivatives Benzenesulfonamides Benzenesulfonyl compounds Medium-chain fatty acids Branched fatty acids Heterocyclic fatty acids Substituted pyrroles Organosulfonamides Heteroaromatic compounds Thioamides Aminosulfonyl compounds Carboxylic acids Thiocarboxylic acid amides Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Organonitrogen compounds Carbonyl compounds Thiocarbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N,n-disubstituted p-toluenesulfonamide - Triptan - Alpha-amino acid or derivatives - Benzenesulfonamide - 3-alkylindole - Benzenesulfonyl group - Indole - Indole or derivatives - Medium-chain fatty acid - Branched fatty acid - Heterocyclic fatty acid - Substituted pyrrole - Organosulfonic acid amide - Fatty acyl - Fatty acid - Aminosulfonyl compound - Heteroaromatic compound - Thioamide - Sulfonyl - Pyrrole - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Organoheterocyclic compound - Thiocarboxylic acid amide - Carboxylic acid derivative - Carboxylic acid - Azacycle - Monocarboxylic acid or derivatives - Carbonyl group - Thiocarbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen 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