Compound Identification
SMILES
COC1=C(OC)C=C(CCNC(=O)CCCCCN2C(=S)NC3=C(C=C(Br)C=C3)C2=O)C=C1
InChIKey
InChIKey=VCFDASSDFPSLKE-UHFFFAOYSA-N
Formula
C24H28BrN3O4S
Mass
534.47
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
Dimethoxybenzenes Anisoles Phenoxy compounds 2-Thiopyrimidines Alkyl aryl ethers Pyrimidones Pyrimidinethiones Aryl bromides N-acyl amines Heteroaromatic compounds Vinylogous amides Thioureas Lactams Secondary carboxylic acid amides Azacyclic compounds Hydrocarbon derivatives Organonitrogen compounds Carbonyl compounds Organic oxides Organobromides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinazoline - Dimethoxybenzene - O-dimethoxybenzene - Anisole - Phenol ether - Phenoxy compound - Methoxybenzene - Alkyl aryl ether - 2-thiopyrimidine - Pyrimidinethione - Pyrimidone - Thiopyrimidine - Fatty acyl - Benzenoid - Aryl halide - Monocyclic benzene moiety - Aryl bromide - Fatty amide - Pyrimidine - N-acyl-amine - Vinylogous amide - Heteroaromatic compound - Thiourea - Secondary carboxylic acid amide - Carboxamide group - Lactam - Ether - Carboxylic acid derivative - Azacycle - Organohalogen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organosulfur 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