Compound Identification
SMILES
CO[C@@H]1CCCN([C@H]1CC(=O)CN1C=NC2=CC(F)=C(SC)C=C2C1=O)C(=O)OCC=C
InChIKey
InChIKey=LRDYJAXMEGGZHY-RBUKOAKNSA-N
Formula
C22H26FN3O5S
Mass
463.52
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazanaphthalenes
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Subclass
Benzodiazines
- 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
Not available
Direct Parent
Quinazolines
Alternative Parents
Piperidinecarboxylic acids Thiophenol ethers Alkylarylthioethers Pyrimidones Aryl fluorides Carbamate esters Heteroaromatic compounds Ketones Lactams Dialkyl ethers Azacyclic compounds Sulfenyl compounds Hydrocarbon derivatives Organic oxides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinazoline - Piperidinecarboxylic acid - Aryl thioether - Thiophenol ether - Pyrimidone - Alkylarylthioether - Aryl fluoride - Aryl halide - Piperidine - Pyrimidine - Benzenoid - Carbamic acid ester - Heteroaromatic compound - Ketone - Lactam - Thioether - Azacycle - Dialkyl ether - Sulfenyl compound - Ether - Organic oxide - Organonitrogen compound - Organofluoride - Organohalogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - 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