Structure Information
Structure

Compound Identification

SMILES

CC(N1CN=C2OC3=CSC(N3N2C1)C1=CC=C(Cl)C=C1)C(O)=O

InChIKey

InChIKey=CFWUPDMIWGMGLB-UHFFFAOYSA-N

Formula

C15H15ClN4O3S

Mass

366.82

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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 - Alpha amino acids and derivatives

Direct Parent

Alanine and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Alanine or derivatives - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Triazine - 1,3,5-triazine - Benzenoid - 1,3,4-oxadiazolidine - Meta-thiazoline - Thioenolether - Organoheterocyclic compound - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid - Oxacycle - Monocarboxylic acid or derivatives - Amine - Organohalogen compound - Organochloride - Imine - Organonitrogen compound - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as alanine and derivatives. These are compounds containing alanine or a derivative thereof resulting from reaction of alanine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.

External Descriptors

Not available

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