Compound Identification
SMILES
CC1=CC=C(C=C1)S(=O)(=O)N1CCN(CC1)C(=O)\C=C\C1=CC=CC=C1C#N
InChIKey
InChIKey=AFXVVRKHJIWUMV-DHZHZOJOSA-N
Formula
C21H21N3O3S
Mass
395.48
Taxonomic Classification
Taxonomy Tree
-
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
Cinnamic acids and derivatives Benzenesulfonamides Benzenesulfonyl compounds Benzonitriles Styrenes Organosulfonamides Piperazines Sulfonyls Tertiary carboxylic acid amides Amino acids and derivatives Tertiary amines Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N,n-disubstituted p-toluenesulfonamide - Cinnamic acid or derivatives - Benzenesulfonamide - Benzenesulfonyl group - Benzonitrile - Styrene - 1,4-diazinane - Piperazine - Organosulfonic acid amide - Organic sulfonic acid or derivatives - Tertiary carboxylic acid amide - Organosulfonic acid or derivatives - Sulfonyl - Carboxamide group - Amino acid or derivatives - Tertiary amine - Azacycle - Nitrile - Carbonitrile - Carboxylic acid derivative - Organoheterocyclic compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Carbonyl group - Amine - Organic nitrogen compound - Cyanide - 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