Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CC(C(=O)NC(C(SC2=CC=CC=C2)C2=CC=C(C=C2)N(CCC#N)CCC#N)C(=O)SC2=CC=CC=C2)=C(Cl)C=C1

InChIKey

InChIKey=UVCFIPGIXHLURX-UHFFFAOYSA-N

Formula

C34H28ClN5O4S2

Mass

670.2

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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

Phenylalanine and derivatives

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Phenylalanine or derivatives - Hippuric acid or derivatives - N-acyl-alpha amino acid or derivatives - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - Nitrobenzene - Thiophenol ester - Aryl thioether - Nitroaromatic compound - Benzoyl - Aniline or substituted anilines - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Thiophenol ether - Chlorobenzene - Halobenzene - Alkylarylthioether - Benzenoid - Aryl halide - Monocyclic benzene moiety - Aryl chloride - Vinylogous halide - Carboxamide group - C-nitro compound - Organic nitro compound - Secondary carboxylic acid amide - Carbothioic s-ester - Tertiary amine - Thiocarboxylic acid ester - Thioether - Thiocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carbonitrile - Nitrile - Sulfenyl compound - Organic oxoazanium - Hydrocarbon derivative - Organic oxide - Amine - Organic nitrogen compound - Organic oxygen compound - Organosulfur compound - Organopnictogen compound - Organic zwitterion - Organohalogen compound - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenylalanine and derivatives. These are compounds containing phenylalanine or a derivative thereof resulting from reaction of phenylalanine 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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