Compound Identification
SMILES
COC(=O)C1=CC(NC(=O)C[NH+](C)CC2=C(C)C=CS2)=C(C)C=C1
InChIKey
InChIKey=PBTBWHYHWHUUJU-UHFFFAOYSA-O
Formula
C18H23N2O3S
Mass
347.45
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 acid amides Benzoic acid esters Anilides Benzoyl derivatives N-arylamides Toluenes Aralkylamines Thiophenes Quaternary ammonium salts Heteroaromatic compounds Methyl esters Secondary carboxylic acid amides Trialkylamines Carbonyl compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - Alpha-amino acid amide - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Benzoate ester - Anilide - Benzoyl - N-arylamide - Aralkylamine - Toluene - Heteroaromatic compound - Quaternary ammonium salt - Methyl ester - Thiophene - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Tertiary amine - Tertiary aliphatic amine - Carboxylic acid derivative - Organoheterocyclic compound - Organic oxide - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Amine - Organic nitrogen compound - Organic cation - 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