Structure Information
Structure

Compound Identification

SMILES

CCCN1C=C(C=C2SC(=NC3=CC=CC(=C3)C(=O)OCC)N(C)C2=O)C2=CC=CC=C12

InChIKey

InChIKey=KJOSGVJXPOYFGO-UHFFFAOYSA-N

Formula

C25H25N3O3S

Mass

447.55

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Benzoic acid esters

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzoate ester - N-alkylindole - Indole - Indole or derivatives - Benzoyl - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Thiazolidine - Carboxylic acid ester - Isothiourea - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.

External Descriptors

Not available

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