Compound Identification
SMILES
COC1=CC=C(C=C1)C(N1CCN(CC1)S(=O)(=O)C1=CC=C(C)C=C1)C1=C(N)N(C)C(=O)N(C)C1=O
InChIKey
InChIKey=QWNQEVLGLNFQFA-UHFFFAOYSA-N
Formula
C25H31N5O5S
Mass
513.61
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
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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 - P-toluenesulfonamides
Direct Parent
N,N-disubstituted p-toluenesulfonamides
Alternative Parents
Benzenesulfonamides Benzenesulfonyl compounds Anisoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers N-alkylpiperazines Aminopyrimidines and derivatives Pyrimidones Aralkylamines Organosulfonamides Hydropyrimidines Sulfonyls Heteroaromatic compounds Vinylogous amides Trialkylamines Lactams Ureas Azacyclic compounds Hydrocarbon derivatives Organic oxides Primary amines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N,n-disubstituted p-toluenesulfonamide - Benzenesulfonamide - Benzenesulfonyl group - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Aminopyrimidine - Pyrimidone - N-alkylpiperazine - Aralkylamine - Piperazine - Hydropyrimidine - Pyrimidine - 1,4-diazinane - Organosulfonic acid amide - Heteroaromatic compound - Vinylogous amide - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Urea - Tertiary amine - Tertiary aliphatic amine - Lactam - Ether - Azacycle - Organoheterocyclic compound - Organic oxide - Primary amine - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - 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