Compound Identification
SMILES
[O-][N+](=O)C1=CC=CC(NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C2=CC(Cl)=C(F)C=C2)=C1
InChIKey
InChIKey=APIXDIHPGMDTHR-UHFFFAOYSA-N
Formula
C22H14ClFN4O4S
Mass
484.89
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
Anilides Nitrobenzenes N-arylamides Nitroaromatic compounds Alkylarylthioethers Chlorobenzenes Fluorobenzenes Pyrimidones Aryl fluorides Aryl chlorides Heteroaromatic compounds Secondary carboxylic acid amides Lactams Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Sulfenyl compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic salts Organic zwitterions Organochlorides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinazoline - Nitrobenzene - Anilide - Aryl thioether - Nitroaromatic compound - N-arylamide - Chlorobenzene - Fluorobenzene - Halobenzene - Pyrimidone - Alkylarylthioether - Monocyclic benzene moiety - Aryl fluoride - Aryl chloride - Pyrimidine - Benzenoid - Aryl halide - Heteroaromatic compound - C-nitro compound - Lactam - Carboxamide group - Organic nitro compound - Secondary carboxylic acid amide - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Carboxylic acid derivative - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Thioether - Sulfenyl compound - Organic zwitterion - Organic nitrogen compound - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Organic salt - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - 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