Compound Identification
SMILES
ClC1=CC=C(C=C1)N1C(SCN2N=NC3=CC=CC=C3C2=O)=NC2=C(C=CC(Cl)=C2)C1=O
InChIKey
InChIKey=AYYJFAZCDIECQG-UHFFFAOYSA-N
Formula
C22H13Cl2N5O2S
Mass
482.34
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
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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
Benzo-1,2,3-triazines Triazinones Pyrimidones Alkylarylthioethers Chlorobenzenes 1,2,3-triazines Aryl chlorides Heteroaromatic compounds Lactams Sulfenyl compounds Azacyclic compounds Organic oxides Organochlorides Organonitrogen compounds Organooxygen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-1,2,3-triazine - Quinazoline - Aryl thioether - Pyrimidone - Triazinone - Chlorobenzene - Alkylarylthioether - Halobenzene - Aryl chloride - Aryl halide - 1,2,3-triazine - Benzenoid - Monocyclic benzene moiety - Triazine - Pyrimidine - Heteroaromatic compound - Lactam - Azacycle - Sulfenyl compound - Thioether - Organonitrogen compound - Organochloride - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organosulfur 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