Compound Identification
SMILES
ClC1=CC=C(CCNC(=O)CCCCCN2C(=S)NC3=C(C=C(Br)C=C3)C2=O)C=C1
InChIKey
InChIKey=CFELDQRYWCJAIY-UHFFFAOYSA-N
Formula
C22H23BrClN3O2S
Mass
508.86
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
Pyrimidones Pyrimidinethiones 2-Thiopyrimidines Chlorobenzenes Aryl bromides Aryl chlorides N-acyl amines Vinylogous amides Heteroaromatic compounds Thioureas Secondary carboxylic acid amides Lactams Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organobromides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinazoline - Chlorobenzene - 2-thiopyrimidine - Halobenzene - Thiopyrimidine - Pyrimidinethione - Pyrimidone - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Fatty amide - N-acyl-amine - Pyrimidine - Benzenoid - Fatty acyl - Vinylogous amide - Heteroaromatic compound - Carboxamide group - Thiourea - Secondary carboxylic acid amide - Lactam - Azacycle - Carboxylic acid derivative - Organosulfur compound - Carbonyl group - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organobromide - Organochloride - Organonitrogen compound - Organooxygen compound - 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