Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=C(NC2=C(C1C1=CC=C(C=C1)N(C)C)C(=O)N=C(N2)SCC1=CC=CC=C1Cl)C1=CC=CC=C1

InChIKey

InChIKey=PUEGQNZHTSNCAX-UHFFFAOYSA-N

Formula

C31H29ClN4O3S

Mass

573.11

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Cinnamic acids and derivatives

Subclass

Cinnamic acid esters

Intermediate Tree Nodes

Not available

Direct Parent

Cinnamic acid esters

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Cinnamic acid ester - Pyridopyrimidine - Aryl thioether - Aniline or substituted anilines - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Chlorobenzene - Halobenzene - Alkylarylthioether - Pyrimidone - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyridine - Pyrimidine - Benzenoid - Heteroaromatic compound - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Amino acid or derivatives - Tertiary amine - Carboxylic acid ester - Sulfenyl compound - Organoheterocyclic compound - Azacycle - Thioether - Carboxylic acid derivative - Enamine - Monocarboxylic acid or derivatives - Organosulfur compound - Amine - Organohalogen compound - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cinnamic acid esters. These are compound containing an ester derivative of cinnamic acid.

External Descriptors

Not available

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