Structure Information
Structure

Compound Identification

SMILES

CC(CSC(CCC1=CC=CC=C1C(=O)N(C)C)C1=CC(OCC2=NC3=C(C=CC(Cl)=C3)C=C2)=CC=C1)C(O)=O

InChIKey

InChIKey=HZJBQKBZJJGRBH-UHFFFAOYSA-N

Formula

C32H33ClN2O4S

Mass

577.14

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Linear 1,3-diarylpropanoids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Linear 1,3-diarylpropanoids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Linear 1,3-diarylpropanoid - Haloquinoline - Chloroquinoline - Quinoline - Benzoic acid or derivatives - Benzamide - Phenoxy compound - Phenol ether - Benzoyl - Alkyl aryl ether - Aryl chloride - Pyridine - Monocyclic benzene moiety - Benzenoid - Aryl halide - Heteroaromatic compound - Tertiary carboxylic acid amide - Tertiary amine - Carboxamide group - Amino acid - Amino acid or derivatives - Azacycle - Organoheterocyclic compound - Dialkylthioether - Sulfenyl compound - Thioether - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Amine - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as linear 1,3-diarylpropanoids. These are organic compounds with a structure based on a C6-C3-C6 skeleton, where the two benzene rings are not linked together.

External Descriptors

Not available

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