Compound Identification
SMILES
COC1=CC(=CNNC(=O)CN2CCN(CC2)S(=O)(=O)C2=CC=C(C)C=C2)C=C(OC)C1=O
InChIKey
InChIKey=VYBJWFIRNYHZOC-UHFFFAOYSA-N
Formula
C22H28N4O6S
Mass
476.55
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
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
N-piperazineacetamides Benzenesulfonamides Alpha amino acids and derivatives Benzenesulfonyl compounds P-quinomethanes N-alkylpiperazines Organosulfonamides Sulfonyls Trialkylamines Carboxylic acid hydrazides Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N,n-disubstituted p-toluenesulfonamide - Alpha-amino acid or derivatives - Benzenesulfonamide - N-piperazineacetamide - Benzenesulfonyl group - P-quinomethane - Quinomethane - N-alkylpiperazine - 1,4-diazinane - Piperazine - Organosulfonic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Tertiary amine - Amino acid or derivatives - Cyclic ketone - Tertiary aliphatic amine - Carboxylic acid hydrazide - Ketone - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Amine - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic oxygen compound - Organosulfur compound - Hydrocarbon derivative - 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