Compound Identification
SMILES
CC1=CC=C(CSC2=NC3=CC=CC=C3C3=NC(CC(=O)NCC4=CC5=C(OCO5)C=C4)C(=O)N23)C=C1
InChIKey
InChIKey=PDKMGAXHFMEVJG-UHFFFAOYSA-N
Formula
C28H24N4O4S
Mass
512.58
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
Alpha amino acids and derivatives Benzodioxoles Toluenes Imidazolinones Secondary carboxylic acid amides Isothioureas Acetals Sulfenyl compounds Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Carboximidamides Carboxamidines Hydrocarbon derivatives Carbonyl compounds Organopnictogen compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Quinazoline - Benzodioxole - Toluene - Monocyclic benzene moiety - Imidazolinone - Benzenoid - 2-imidazoline - Carboxamide group - Isothiourea - Secondary carboxylic acid amide - Acetal - Amidine - Carboxylic acid amidine - Carboxylic acid derivative - Oxacycle - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Carboximidamide - Hydrocarbon derivative - Organic oxygen compound - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Organic nitrogen compound - Organic oxide - 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