Compound Identification
SMILES
CCN1C(COC2=CC=CC=C2)=NN=C1SCC(=O)NC1=CC=C(C=C1)C(=O)OC
InChIKey
InChIKey=OCMOXJULXFUBPD-UHFFFAOYSA-N
Formula
C21H22N4O4S
Mass
426.49
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
Benzoic acid esters Anilides Benzoyl derivatives N-arylamides Phenol ethers Phenoxy compounds Alkylarylthioethers Alkyl aryl ethers Methyl esters Heteroaromatic compounds Triazoles Secondary carboxylic acid amides Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - Benzoate ester - Anilide - Phenoxy compound - Aryl thioether - Benzoyl - Phenol ether - N-arylamide - Alkyl aryl ether - Alkylarylthioether - Azole - 1,2,4-triazole - Heteroaromatic compound - Methyl ester - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Sulfenyl compound - Organoheterocyclic compound - Thioether - Azacycle - Carboxylic acid derivative - Ether - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Organic oxide - Organic nitrogen compound - Organic oxygen 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