Compound Identification
SMILES
CCOC1=C(OCC2=NN=C(SCC(=O)NC3=C(Cl)C=CC(=C3)C(=O)OC)N2CC=C)C=CC(C)=C1
InChIKey
InChIKey=UZDXQKOELNOHTQ-UHFFFAOYSA-N
Formula
C25H27ClN4O5S
Mass
531.02
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
4-halobenzoic acids and derivatives Benzoic acid esters Anilides Phenoxy compounds Phenol ethers N-arylamides Benzoyl derivatives Toluenes Alkyl aryl ethers Alkylarylthioethers Chlorobenzenes Aryl chlorides Triazoles Methyl esters Heteroaromatic compounds Secondary carboxylic acid amides Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoate ester - Anilide - Phenol ether - Phenoxy compound - N-arylamide - Benzoyl - Aryl thioether - Alkylarylthioether - Toluene - Chlorobenzene - Halobenzene - Alkyl aryl ether - Aryl chloride - Aryl halide - 1,2,4-triazole - Methyl ester - Heteroaromatic compound - Azole - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Thioether - Ether - Sulfenyl compound - Organic oxygen compound - Organohalogen compound - Organic nitrogen compound - Carbonyl group - Organochloride - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organosulfur 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