Compound Identification
SMILES
CC1=CC=C(C=C1)S(=O)(=O)N1CCN(C(COCC2=CC(=CC=C2)C(F)(F)F)CC2=CC=CC=C2)C(=O)CC1
InChIKey
InChIKey=FEDINYRJSNZBFK-UHFFFAOYSA-N
Formula
C29H31F3N2O4S
Mass
560.63
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
-
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
Trifluoromethylbenzenes Amphetamines and derivatives Benzenesulfonamides Benzenesulfonyl compounds Benzylethers 1,4-diazepanes Organosulfonamides Tertiary carboxylic acid amides Sulfonyls Lactams Azacyclic compounds Dialkyl ethers Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides Alkyl fluorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N,n-disubstituted p-toluenesulfonamide - Amphetamine or derivatives - Trifluoromethylbenzene - Benzenesulfonamide - Benzenesulfonyl group - Benzylether - 1,4-diazepane - Diazepane - Organosulfonic acid amide - Tertiary carboxylic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Carboxamide group - Lactam - Azacycle - Carboxylic acid derivative - Dialkyl ether - Organoheterocyclic compound - Ether - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen 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