Compound Identification
SMILES
CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)NN=CC1=CC=C(OC(=O)C2=CC=CS2)C=C1
InChIKey
InChIKey=YIJGKBQPHHGVMZ-UHFFFAOYSA-N
Formula
C21H19N3O5S2
Mass
457.52
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
-
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
Direct Parent
P-toluenesulfonamides
Alternative Parents
Phenol esters Benzenesulfonamides Alpha amino acids and derivatives Benzenesulfonyl compounds Thiophene carboxylic acids and derivatives Phenoxy compounds Organosulfonamides Heteroaromatic compounds Aminosulfonyl compounds Carboxylic acid esters Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
P-toluenesulfonamide - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Benzenesulfonamide - Phenol ester - Benzenesulfonyl group - Phenoxy compound - Thiophene carboxylic acid or derivatives - Organosulfonic acid amide - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Heteroaromatic compound - Sulfonyl - Thiophene - Aminosulfonyl compound - Carboxylic acid ester - Organoheterocyclic compound - Carboxylic acid derivative - Organic nitrogen compound - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic oxide - Carbonyl group - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as p-toluenesulfonamides. These are aromatic heterocyclic compounds containing a toluene that is p-substituted with a sulfonamide group.
External Descriptors
Not available