Compound Identification
SMILES
COC1=CC=C(NC(=O)C(=O)NCCN2CCN(CC2)S(=O)(=O)C2=CC=C(C)C=C2)C=C1
InChIKey
InChIKey=AZBVOYZWQQDJLO-UHFFFAOYSA-N
Formula
C22H28N4O5S
Mass
460.55
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
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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
Alpha amino acid amides Benzenesulfonamides Methoxyanilines Anilides Benzenesulfonyl compounds Phenoxy compounds N-arylamides Methoxybenzenes Anisoles Alkyl aryl ethers N-alkylpiperazines Organosulfonamides Sulfonyls Trialkylamines Secondary carboxylic acid amides Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N,n-disubstituted p-toluenesulfonamide - Alpha-amino acid amide - Alpha-amino acid or derivatives - Benzenesulfonamide - Anilide - Methoxyaniline - Benzenesulfonyl group - Phenol ether - N-arylamide - Phenoxy compound - Methoxybenzene - Anisole - Alkyl aryl ether - N-alkylpiperazine - 1,4-diazinane - Organosulfonic acid amide - Piperazine - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Amino acid or derivatives - Carboxamide group - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Ether - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Organonitrogen compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Amine - Organic oxide - 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