Structure Information
Structure

Compound Identification

SMILES

CCCCCCN1N=C(C(=O)OCC(=O)NC2=C(C#N)C3=C(CCCC3)S2)C2=CC=CC=C2C1=O

InChIKey

InChIKey=ULLOIFFTELPYRK-UHFFFAOYSA-N

Formula

C26H28N4O4S

Mass

492.59

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazanaphthalenes

Subclass

Benzodiazines

Intermediate Tree Nodes

Phthalazines

Direct Parent

Phthalazinones

Alternative Parents

N-arylamides Pyridazinones Benzenoids Thiophenes Heteroaromatic compounds Secondary carboxylic acid amides Lactams Carboxylic acid esters Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phthalazinone - N-arylamide - Pyridazinone - Pyridazine - Benzenoid - Thiophene - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid ester - Lactam - Azacycle - Carboxylic acid derivative - Carbonitrile - Nitrile - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Cyanide - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phthalazinones. These are compounds containing a phthalazine bearing a ketone group.

External Descriptors

Not available

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