Structure Information
Structure

Compound Identification

SMILES

NC1=NC=NC2=C1C=CC(CN1CCN(CC1=O)C(=O)CSC1=CC(Cl)=CC=C1)=C2

InChIKey

InChIKey=NQSMECOIHVZFNQ-UHFFFAOYSA-N

Formula

C21H20ClN5O2S

Mass

441.93

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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

Alpha amino acids and derivatives Thiophenol ethers Alkylarylthioethers Aminopyrimidines and derivatives N-alkylpiperazines Chlorobenzenes Aryl chlorides Imidolactams Tertiary carboxylic acid amides Heteroaromatic compounds Lactams Sulfenyl compounds Azacyclic compounds Primary amines Organic oxides Organochlorides Carbonyl compounds Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Quinazolinamine - Alpha-amino acid or derivatives - Aryl thioether - Thiophenol ether - Aminopyrimidine - Halobenzene - Chlorobenzene - N-alkylpiperazine - Alkylarylthioether - Benzenoid - 1,4-diazinane - Pyrimidine - Aryl chloride - Imidolactam - Monocyclic benzene moiety - Piperazine - Aryl halide - Tertiary carboxylic acid amide - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - Lactam - Azacycle - Carboxylic acid derivative - Sulfenyl compound - Thioether - Organosulfur compound - Primary amine - Organic nitrogen compound - Organohalogen compound - Amine - Carbonyl group - Organochloride - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - 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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