Compound Identification
SMILES
COC(=O)C1=CNN2C(C3=CC=C(F)C=C3)C3=C(CCCC3=O)N=C12
InChIKey
InChIKey=JIWBGUIEBBXUHQ-UHFFFAOYSA-N
Formula
C18H16FN3O3
Mass
341.342
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
Pyrazolopyrimidines Cyclohexenones Fluorobenzenes Aryl fluorides Hydropyrimidines Imidolactams Methyl esters Pyrazolines Enoate esters Vinylogous amides Pyrazoles Amidrazones Monocarboxylic acids and derivatives Amidines Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxides Hydrocarbon derivatives Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinazoline - Pyrazolopyrimidine - Cyclohexenone - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Hydropyrimidine - Imidolactam - 1,6-dihydropyrimidine - Benzenoid - Pyrimidine - Vinylogous amide - Pyrazole - Pyrazoline - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Carboxylic acid amidrazone - Carboxylic acid ester - Ketone - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Amidine - Azacycle - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organofluoride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxygen 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