Compound Identification
SMILES
COC(=O)CNC(=O)C1=CC(Cl)=C(NC(=O)CSC2=NC=NC=C2C2=CC=CC3=CC=CC=C23)C=C1
InChIKey
InChIKey=PZFBBRGLTDSOJP-UHFFFAOYSA-N
Formula
C26H21ClN4O4S
Mass
520.99
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
Alpha amino acid esters N-acyl-alpha amino acids and derivatives Hippuric acids and derivatives Phenylpyrimidines 3-halobenzoic acids and derivatives Naphthalenes Anilides N-arylamides Benzoyl derivatives Alkylarylthioethers Chlorobenzenes Aryl chlorides Methyl esters Heteroaromatic compounds Secondary carboxylic acid amides Sulfenyl compounds Monocarboxylic acids and derivatives Azacyclic compounds Organochlorides Hydrocarbon derivatives Organic oxides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Acylaminobenzoic acid or derivatives - N-acyl-alpha amino acid or derivatives - Hippuric acid or derivatives - 5-phenylpyrimidine - Alpha-amino acid or derivatives - Naphthalene - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzamide - Anilide - Aryl thioether - Benzoyl - N-arylamide - Alkylarylthioether - Halobenzene - Chlorobenzene - Aryl chloride - Pyrimidine - Aryl halide - Methyl ester - Heteroaromatic compound - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Thioether - Sulfenyl compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organosulfur compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organochloride - 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