Compound Identification
SMILES
COC1=CC(OC)=C(C=C1)N1C(=O)NC2=C(C=C(Br)C=C2)C1(O)C(=O)NCCC[NH+]1CCCCC1
InChIKey
InChIKey=BXVGXLJPPQBQFJ-UHFFFAOYSA-O
Formula
C25H32BrN4O5
Mass
548.457
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
Alpha amino acids and derivatives Dimethoxybenzenes Methoxyanilines Phenoxy compounds Anisoles Pyrimidones Alkyl aryl ethers Piperidines Aryl bromides Ureas Trialkylamines Secondary carboxylic acid amides Alkanolamines Azacyclic compounds Organopnictogen compounds Organic oxides Organobromides Carbonyl compounds Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Quinazoline - M-dimethoxybenzene - Dimethoxybenzene - Methoxyaniline - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Pyrimidone - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Piperidine - Pyrimidine - Benzenoid - Urea - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Carbonic acid derivative - Azacycle - Alkanolamine - Carboxylic acid derivative - Ether - Organopnictogen compound - Hydrocarbon derivative - Organohalogen compound - Organobromide - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Amine - Organic cation - 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