Compound Identification
SMILES
CCOC(=O)C1=CC(Br)=C(NC(=O)CSC2=NC3=C(N=CC=C3)N2C2=C(C)C=C(C)C=C2C)C=C1
InChIKey
InChIKey=RZLLJAIVIOOOET-UHFFFAOYSA-N
Formula
C26H25BrN4O3S
Mass
553.48
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
Phenylimidazoles 3-halobenzoic acids and derivatives Benzoic acid esters Anilides Imidazopyridines N-arylamides Benzoyl derivatives Alkylarylthioethers Bromobenzenes Pyridines and derivatives Aryl bromides N-substituted imidazoles Heteroaromatic compounds Carboxylic acid esters Secondary carboxylic acid amides Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organobromides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - 1-phenylimidazole - Benzoate ester - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Imidazopyridine - Anilide - Aryl thioether - Benzoyl - N-arylamide - Halobenzene - Bromobenzene - Alkylarylthioether - N-substituted imidazole - Aryl bromide - Aryl halide - Pyridine - Imidazole - Azole - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxylic acid ester - Carboxamide group - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Carboxylic acid derivative - Thioether - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - 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