Structure Information
Structure

Compound Identification

SMILES

C[C@H](OC(=O)CSC1=C(C#N)C(C)=CC(=O)N1)C1=NC(=O)C2=CC=CC=C2N1

InChIKey

InChIKey=YNYJKVURZKNWRA-NSHDSACASA-N

Formula

C19H16N4O4S

Mass

396.42

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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 - 3-pyridinecarbonitrile - Dihydropyridine - Methylpyridine - Pyridinone - Alkylarylthioether - Pyrimidone - Hydropyridine - Pyridine - Benzenoid - Pyrimidine - Heteroaromatic compound - Vinylogous amide - Carboxylic acid ester - Lactam - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Azacycle - Sulfenyl compound - Thioether - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxygen compound - Cyanide - Organic oxide - 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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