Compound Identification
SMILES
COC(=O)C1=CC=C(NC(=O)CC2N(CCC3=CC=CC=C3)C(=S)N(C2=O)C2=CC=C(OC)C=C2)C=C1
InChIKey
InChIKey=XLHCMRPRTSCVHR-UHFFFAOYSA-N
Formula
C28H27N3O5S
Mass
517.6
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
Phenylimidazolidines Alpha amino acids and derivatives Benzoic acid esters N-phenylthioureas Anilides Methoxyanilines N-arylamides Methoxybenzenes Benzoyl derivatives Anisoles Phenoxy compounds Alkyl aryl ethers Imidazolidinones Methyl esters Thioureas Secondary carboxylic acid amides Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - Phenylimidazolidine - Alpha-amino acid or derivatives - Benzoate ester - N-phenylthiourea - Anilide - Methoxyaniline - Anisole - Phenoxy compound - Benzoyl - Phenol ether - N-arylamide - Methoxybenzene - Alkyl aryl ether - Imidazolidinone - Methyl ester - Imidazolidine - Thiourea - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Organic oxide - Organic oxygen compound - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - 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