Structure Information
Structure

Compound Identification

SMILES

NCCC(C(=O)N1CC2=C(C1)C(=NN2)C1=CC=C(S1)C(O)=O)C1=CC=CC=C1

InChIKey

InChIKey=HLDLRKZWBCBXLY-UHFFFAOYSA-N

Formula

C20H20N4O3S

Mass

396.47

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Subclass

Amino acids, peptides, and analogues

Intermediate Tree Nodes

Amino acids and derivatives

Direct Parent

Gamma amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Gamma amino acid or derivatives - Phenylacetamide - Pyrrolopyrazole - Thiophene carboxylic acid - Thiophene carboxylic acid or derivatives - 2,5-disubstituted thiophene - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Azole - Pyrazole - Pyrrole - Tertiary carboxylic acid amide - Thiophene - Heteroaromatic compound - Amino acid - Carboxamide group - Carboxylic acid - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organic oxide - Amine - Primary amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as gamma amino acids and derivatives. These are amino acids having a (-NH2) group attached to the gamma carbon atom.

External Descriptors

Not available

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