Compound Identification
SMILES
Cl.Cl.O[C@H]1CCCN[C@@H]1CC(=O)CN1C=NC2=CC(Cl)=C(SCC3=CC=NC=C3)C=C2C1=O
InChIKey
InChIKey=QBKNLALGPDJUKC-AAYDIPMQSA-N
Formula
C22H25Cl3N4O3S
Mass
531.88
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazanaphthalenes
-
Subclass
Benzodiazines
- Level 5 Quinazolines
-
Subclass
Benzodiazines
-
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
Thiophenol ethers Alkylarylthioethers Pyrimidones Aryl chlorides Beta-amino ketones Piperidines Pyridines and derivatives Heteroaromatic compounds Lactams 1,2-aminoalcohols Secondary alcohols Dialkylamines Sulfenyl compounds Azacyclic compounds Organic oxides Hydrochlorides Hydrocarbon derivatives Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinazoline - Aryl thioether - Thiophenol ether - Pyrimidone - Alkylarylthioether - Aryl chloride - Aryl halide - Beta-aminoketone - Piperidine - Pyridine - Pyrimidine - Benzenoid - Heteroaromatic compound - Secondary alcohol - 1,2-aminoalcohol - Ketone - Lactam - Thioether - Secondary amine - Azacycle - Sulfenyl compound - Secondary aliphatic amine - Organic oxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Organic oxide - Alcohol - Amine - Hydrocarbon derivative - Hydrochloride - Organic nitrogen 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