Structure Information
Structure

Compound Identification

SMILES

CS(=N)(=O)CCC(NC(=O)C1=CC=C(NCC2=CN=C3NC(N)=NC(=O)C3=N2)C=C1)C(O)=O

InChIKey

InChIKey=VEHLMSBVCGNBOQ-UHFFFAOYSA-N

Formula

C19H22N8O5S

Mass

474.5

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Benzamides - Hippuric acids and derivatives

Direct Parent

Hippuric acids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

N-acyl-alpha amino acid or derivatives - N-acyl-alpha-amino acid - Hippuric acid - Pterin - Alpha-amino acid or derivatives - Aminobenzamide - Aminobenzoic acid or derivatives - Pteridine - Phenylalkylamine - Aniline or substituted anilines - Benzoyl - Aminopyrimidine - Aralkylamine - Pyrimidone - Thia fatty acid - Secondary aliphatic/aromatic amine - Fatty acyl - Pyrazine - Pyrimidine - Heteroaromatic compound - Vinylogous amide - Carbo-azosulfone - Amino acid - Amino acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Organoheterocyclic compound - Secondary amine - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxide - Organic oxygen compound - Carbonyl group - Amine - Hydrocarbon derivative - Primary amine - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as hippuric acids. These are compounds containing hippuric acid, which consists of a of a benzoyl group linked to the N-terminal of a glycine.

External Descriptors

Not available

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