Structure Information
Structure

Compound Identification

SMILES

OC(=O)C1=CC=CC=C1C1=CC=C(CNC2=NC(=NC3=CC=CC=C23)C(F)(F)F)S1

InChIKey

InChIKey=CELVASLHLLEPBL-UHFFFAOYSA-N

Formula

C21H14F3N3O2S

Mass

429.42

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazanaphthalenes

Subclass

Benzodiazines

Intermediate Tree Nodes

Quinazolines

Direct Parent

Quinazolinamines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Quinazolinamine - Benzoic acid or derivatives - Benzoic acid - Benzoyl - Aminopyrimidine - 2,5-disubstituted thiophene - Monocyclic benzene moiety - Pyrimidine - Benzenoid - Imidolactam - Heteroaromatic compound - Thiophene - Azacycle - Carboxylic acid derivative - Carboxylic acid - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Alkyl fluoride - Organooxygen compound - Alkyl halide - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as quinazolinamines. These are heterocyclic aromatic compounds containing a quianazoline moiety substituted by one or more amine groups.

External Descriptors

Not available

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