Structure Information
Structure

Compound Identification

SMILES

Cl.Cl.O[C@H]1CCCN[C@@H]1CC(=O)CN1C=NC2=CC(Cl)=C(SCC3=CC=NC=C3)C=C2C1=O

InChIKey

InChIKey=QBKNLALGPDJUKC-AAYDIPMQSA-N

Formula

C22H25Cl3N4O3S

Mass

531.88

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazanaphthalenes

Subclass

Benzodiazines

Intermediate Tree Nodes

Not available

Direct Parent

Quinazolines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Quinazoline - Aryl thioether - Thiophenol ether - Pyrimidone - Alkylarylthioether - Aryl chloride - Aryl halide - Beta-aminoketone - Piperidine - Pyridine - Pyrimidine - Benzenoid - Heteroaromatic compound - Secondary alcohol - 1,2-aminoalcohol - Ketone - Lactam - Thioether - Secondary amine - Azacycle - Sulfenyl compound - Secondary aliphatic amine - Organic oxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Organic oxide - Alcohol - Amine - Hydrocarbon derivative - Hydrochloride - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as quinazolines. These are compounds containing a quinazoline moiety, which is made up of two fused six-member aromatic rings, a benzene ring and a pyrimidine ring.

External Descriptors

Not available

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