Compound Identification
SMILES
CC(C)[C@H](N)C(=O)OCN1C=CSC1=NC(=O)C1=CC(Cl)=C(NC(=O)CC2CCCC2)C=C1
InChIKey
InChIKey=JJEOPVDWHLTHLH-FQEVSTJZSA-N
Formula
C23H29ClN4O4S
Mass
493.02
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
Valine and derivatives Alpha amino acid esters 3-halobenzoic acids and derivatives Anilides Benzoyl derivatives N-arylamides Fatty acid esters Chlorobenzenes Aryl chlorides Heteroaromatic compounds Thiazoles Isothioureas Carboxylic acid esters Secondary carboxylic acid amides Monocarboxylic acids and derivatives Azacyclic compounds Monoalkylamines Hydrocarbon derivatives Carbonyl compounds Organochlorides Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid ester - Valine or derivatives - Acylaminobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Alpha-amino acid or derivatives - Anilide - Benzoyl - N-arylamide - Fatty acid ester - Halobenzene - Chlorobenzene - Fatty acyl - Aryl halide - Aryl chloride - Heteroaromatic compound - Azole - Thiazole - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Isothiourea - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organonitrogen compound - Amine - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Primary amine - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Primary aliphatic amine - Organohalogen compound - Organochloride - Aromatic heteromonocyclic 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