Compound Identification
SMILES
CC1=CC2=C(C=C1)N=C(SCC(=O)NNC1=C3C=C(Br)C=CC3=NC1=O)N(C1=CC=CC=C1)C2=O
InChIKey
InChIKey=NCTCUXROCKSYSB-UHFFFAOYSA-N
Formula
C25H18BrN5O3S
Mass
548.42
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Diazanaphthalenes
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Subclass
Benzodiazines
- Level 5 Quinazolines
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Subclass
Benzodiazines
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Class
Diazanaphthalenes
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazanaphthalenes
Subclass
Benzodiazines
Intermediate Tree Nodes
Not available
Direct Parent
Quinazolines
Alternative Parents
Alpha amino acids and derivatives Indoles and derivatives Pyrimidones Alkylarylthioethers Aryl bromides Benzene and substituted derivatives Heteroaromatic compounds N-acylimines Lactams Carboxylic acid hydrazides Sulfenyl compounds Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organobromides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Quinazoline - Indole or derivatives - Aryl thioether - Pyrimidone - Alkylarylthioether - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Pyrimidine - Benzenoid - Heteroaromatic compound - N-acylimine - Carboxylic acid hydrazide - Lactam - Thioether - Carboxylic acid derivative - Azacycle - Sulfenyl compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - 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