Compound Identification
SMILES
CN(CC(=O)NNC(=O)C1=NNC2=CC=CC=C12)S(=O)(=O)C1=CC=C(C)C=C1
InChIKey
InChIKey=WWTLHISHPMZGBL-UHFFFAOYSA-N
Formula
C18H19N5O4S
Mass
401.44
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Benzenoids
-
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
Indazole-3-carboxamides Benzenesulfonamides Alpha amino acids and derivatives Benzenesulfonyl compounds Pyrazole-5-carboxamides Organosulfonamides Heteroaromatic compounds Aminosulfonyl compounds Carboxylic acid hydrazides Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N,n-disubstituted p-toluenesulfonamide - Indazole-3-carboxamide - Alpha-amino acid or derivatives - Benzenesulfonamide - Benzenesulfonyl group - Benzopyrazole - Indazole - Pyrazole-5-carboxamide - Organosulfonic acid amide - Azole - Heteroaromatic compound - Pyrazole - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Carboxylic acid hydrazide - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - 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