Compound Identification
SMILES
COC1=C(OC)C=C2[C@@H]3N(CCC2=C1)CN(C1=CC=CC=C31)S(=O)(=O)C1=CC=C(C)C=C1
InChIKey
InChIKey=JTLAHJVCHJXWIK-RUZDIDTESA-N
Formula
C25H26N2O4S
Mass
450.55
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
Tetrahydroisoquinolines Quinazolines Pyridopyrimidines Benzenesulfonamides Benzenesulfonyl compounds Anisoles Alkyl aryl ethers Pyrimidines and pyrimidine derivatives Pyridines and derivatives Organosulfonamides Sulfonyls Azacyclic compounds Organic oxides Hydrocarbon derivatives Amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N,n-disubstituted p-toluenesulfonamide - Benzenesulfonamide - Pyridopyrimidine - Tetrahydroisoquinoline - Quinazoline - Benzenesulfonyl group - Anisole - Phenol ether - Alkyl aryl ether - Pyridine - Organosulfonic acid amide - Pyrimidine - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Ether - Azacycle - Organoheterocyclic compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Amine - Organic oxygen 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