Compound Identification
SMILES
COC(=O)C1=CC=C(NC(=O)CSC2=NC(=CC3=CC(Cl)=C(Cl)C=C3)C(=O)N2C2=CC=C(C)C=C2)C=C1
InChIKey
InChIKey=JQVKZANPKQEXEJ-UHFFFAOYSA-N
Formula
C27H21Cl2N3O4S
Mass
554.44
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 acids and derivatives Benzoic acid esters Anilides Benzoyl derivatives Dichlorobenzenes Imidazolyl carboxylic acids and derivatives N-arylamides Toluenes Aryl chlorides Imidazolinones Methyl esters Isothioureas Secondary carboxylic acid amides Sulfenyl compounds Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - Alpha-amino acid or derivatives - Benzoate ester - Anilide - Imidazolyl carboxylic acid derivative - 1,2-dichlorobenzene - Benzoyl - N-arylamide - Halobenzene - Toluene - Chlorobenzene - Aryl halide - Aryl chloride - Imidazolinone - 2-imidazoline - Methyl ester - Carboxamide group - Secondary carboxylic acid amide - Isothiourea - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - 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