Compound Identification
SMILES
COC(=O)C1=CC(CN(CCN(CCCO)S(=O)(=O)C2=CC=C(C)C=C2)CC2=CC=CC(CN(CC3=CC=CC(=C3)C(=O)OC)CC3=CC=CC(=C3)C(=O)OC)=N2)=CC=C1
InChIKey
InChIKey=HNBUBSCMBFISEE-UHFFFAOYSA-N
Formula
C46H52N4O9S
Mass
837.0
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 - P-toluenesulfonamides
Direct Parent
N,N-disubstituted p-toluenesulfonamides
Alternative Parents
Benzenesulfonamides Benzoic acid esters 6-substituted-2-pyridinylmethylamines Benzenesulfonyl compounds Phenylmethylamines Benzoyl derivatives Benzylamines Aralkylamines Organosulfonamides Methyl esters Aminosulfonyl compounds Heteroaromatic compounds Trialkylamines Amino acids and derivatives Azacyclic compounds Alkanolamines Hydrocarbon derivatives Organic oxides Primary alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N,n-disubstituted p-toluenesulfonamide - Benzenesulfonamide - Benzoate ester - 6-substituted-2-pyridinylmethylamine - Benzoic acid or derivatives - Benzenesulfonyl group - 2-pyridylmethylamine - Benzoyl - Benzylamine - Phenylmethylamine - Aralkylamine - Pyridine - Organosulfonic acid amide - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Methyl ester - Sulfonyl - Aminosulfonyl compound - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Carboxylic acid ester - Alkanolamine - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organonitrogen compound - Alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Organooxygen compound - Organosulfur compound - Primary alcohol - Aromatic heteromonocyclic 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