Compound Identification
SMILES
CC1=NC(=O)C2=CC(CN(CC#C)C3=CC(F)=C(C=C3)C(=O)NCC3=CC=CC=N3)=C(C)C=C2N1
InChIKey
InChIKey=VFBHWSHDVLQQPY-UHFFFAOYSA-N
Formula
C27H24FN5O2
Mass
469.52
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
2-halobenzoic acids and derivatives Aminobenzamides Benzamides Aniline and substituted anilines Benzoyl derivatives Dialkylarylamines Aralkylamines Pyrimidones Fluorobenzenes Pyridines and derivatives Aryl fluorides Heteroaromatic compounds Vinylogous halides Vinylogous amides Amino acids and derivatives Secondary carboxylic acid amides Acetylides Azacyclic compounds Hydrocarbon derivatives Organopnictogen compounds Organic oxides Organofluorides Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aminobenzamide - Aminobenzoic acid or derivatives - Quinazoline - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - Benzoyl - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - Dialkylarylamine - Fluorobenzene - Halobenzene - Pyrimidone - Aralkylamine - Benzenoid - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Pyridine - Pyrimidine - Vinylogous halide - Heteroaromatic compound - Vinylogous amide - Tertiary amine - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Azacycle - Acetylide - Carboxylic acid derivative - Organooxygen compound - Organic oxide - Amine - Organic oxygen compound - Organopnictogen compound - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organofluoride - Organonitrogen 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