Structure Information
Structure

Compound Identification

SMILES

FC(F)OC1=CC=CC=C1C=C1SC(=S)N(CCC(=O)NC2=NC3=CC=CC=C3S2)C1=O

InChIKey

InChIKey=BQPYNQGXJUMVBI-UHFFFAOYSA-N

Formula

C21H15F2N3O3S3

Mass

491.55

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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

Beta amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Beta amino acid or derivatives - 1,3-benzothiazole - Phenoxy compound - Phenol ether - N-arylamide - Monocyclic benzene moiety - Benzenoid - Thiazolidinethione - Azole - Cyclic dithiocarbamic acid ester - Heteroaromatic compound - Dithiocarbamic acid ester - Thiazole - Thiazolidine - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Organoheterocyclic compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl fluoride - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Aromatic heteropolycyclic compound

Description

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

External Descriptors

Not available

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