Compound Identification
SMILES
COC1=CC=CC=C1N1CCN(CC1)C(=O)C1=CC=CC=C1N(CC1=CC=CC=C1)S(=O)(=O)C1=CC=C(C)C=C1
InChIKey
InChIKey=ZKBLDUYDQVKHGE-UHFFFAOYSA-N
Formula
C32H33N3O4S
Mass
555.69
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
N-arylpiperazines Phenylpiperazines Benzenesulfonamides Sulfanilides Aminophenyl ethers Benzamides Benzenesulfonyl compounds Methoxyanilines Methoxybenzenes Anisoles Dialkylarylamines Benzoyl derivatives Phenoxy compounds Alkyl aryl ethers Organosulfonamides Aminosulfonyl compounds Vinylogous amides Tertiary carboxylic acid amides Amino acids and derivatives Azacyclic compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N,n-disubstituted p-toluenesulfonamide - Phenylpiperazine - N-arylpiperazine - Sulfanilide - Benzenesulfonamide - Aminophenyl ether - Benzamide - Benzenesulfonyl group - Benzoic acid or derivatives - Methoxyaniline - Tertiary aliphatic/aromatic amine - Methoxybenzene - Aniline or substituted anilines - Dialkylarylamine - Benzoyl - Phenol ether - Anisole - Phenoxy compound - Alkyl aryl ether - 1,4-diazinane - Piperazine - Organosulfonic acid amide - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Tertiary carboxylic acid amide - Aminosulfonyl compound - Vinylogous amide - Sulfonyl - Tertiary amine - Amino acid or derivatives - Carboxamide group - Azacycle - Ether - Organoheterocyclic compound - Carboxylic acid derivative - Amine - Organic nitrogen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organosulfur compound - 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