Compound Identification
SMILES
ClC1=CC(NC2=COC(=N2)N2C(CC3=CC=CC=C3NC3=C(Cl)C=CC=C3Cl)=NC3=C(C=C(Br)C=C3)C2=O)=C(Cl)C=C1
InChIKey
InChIKey=QKSJRWKMQIHLEA-UHFFFAOYSA-N
Formula
C30H18BrCl4N5O2
Mass
702.21
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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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
Aniline and substituted anilines Dichlorobenzenes 2,4-disubstituted oxazoles Pyrimidones Primary aromatic amines Aryl bromides Aryl chlorides Imidolactams Heteroaromatic compounds Lactams Secondary amines Oxacyclic compounds Azacyclic compounds Organooxygen compounds Organochlorides Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinazoline - 1,4-dichlorobenzene - 1,3-dichlorobenzene - Aniline or substituted anilines - 2,4-disubstituted 1,3-oxazole - Chlorobenzene - Halobenzene - Pyrimidone - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Primary aromatic amine - Pyrimidine - Benzenoid - Imidolactam - Azole - Oxazole - Heteroaromatic compound - Lactam - Secondary amine - Azacycle - Oxacycle - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Amine - Organobromide - Organochloride - Organonitrogen compound - Organooxygen 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