Compound Identification
SMILES
COC1=C(O[C@@H]2CO[C@H]3[C@H](F)CO[C@@H]23)C=C2N=CN=C(NC3=C(F)C=C(F)C=C3Br)C2=C1
InChIKey
InChIKey=HJOMYFVOXGNASK-PTLICHBZSA-N
Formula
C21H17BrF3N3O4
Mass
512.283
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
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Level 5
Quinazolines
- Level 6 Quinazolinamines
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Level 5
Quinazolines
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Subclass
Benzodiazines
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Class
Diazanaphthalenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazanaphthalenes
Subclass
Benzodiazines
Intermediate Tree Nodes
Quinazolines
Direct Parent
Quinazolinamines
Alternative Parents
Aniline and substituted anilines Anisoles Furofurans Alkyl aryl ethers Aminopyrimidines and derivatives Bromobenzenes Fluorobenzenes Aryl bromides Aryl fluorides Imidolactams Oxolanes Heteroaromatic compounds Dialkyl ethers Azacyclic compounds Secondary amines Oxacyclic compounds Organobromides Alkyl fluorides Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinazolinamine - Anisole - Furofuran - Aniline or substituted anilines - Phenol ether - Alkyl aryl ether - Aminopyrimidine - Bromobenzene - Fluorobenzene - Halobenzene - Aryl bromide - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Imidolactam - Benzenoid - Pyrimidine - Oxolane - Heteroaromatic compound - Secondary amine - Azacycle - Oxacycle - Ether - Dialkyl ether - Organobromide - Organic oxygen compound - Amine - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organohalogen compound - Hydrocarbon derivative - 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