Compound Identification
SMILES
CCOC(=O)C1=CC=C(NC(=O)CSC2=NC(=NC3=C2C=C(Cl)C=C3)C2=CC=CC=C2)C=C1
InChIKey
InChIKey=TUSYOLZHQYVWNH-UHFFFAOYSA-N
Formula
C25H20ClN3O3S
Mass
477.96
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Acylaminobenzoic acid and derivatives
Alternative Parents
Quinazolines Benzoic acid esters Anilides N-arylamides Benzoyl derivatives Alkylarylthioethers Pyrimidines and pyrimidine derivatives Aryl chlorides Heteroaromatic compounds Carboxylic acid esters Secondary carboxylic acid amides Azacyclic compounds Sulfenyl compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - Benzoate ester - Quinazoline - Anilide - Benzoyl - Aryl thioether - N-arylamide - Alkylarylthioether - Aryl chloride - Aryl halide - Pyrimidine - Heteroaromatic compound - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Thioether - Sulfenyl compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic oxide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as acylaminobenzoic acid and derivatives. These are derivatives of amino benzoic acid derivatives where the amine group is N-acylated.
External Descriptors
Not available