Compound Identification
SMILES
COC1=CC=C(CNC(=O)CC2N=C3N(C2=O)C(SCC2=C(C)C=C(C)C=C2)=NC2=CC=CC=C32)C=C1
InChIKey
InChIKey=XZTQKSGKKBTLPE-UHFFFAOYSA-N
Formula
C29H28N4O3S
Mass
512.63
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 m-Xylenes Anisoles Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Imidazolinones Isothioureas Secondary carboxylic acid amides Sulfenyl compounds Carboximidamides Carboxamidines Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Quinazoline - Anisole - Phenol ether - Phenoxy compound - Methoxybenzene - Xylene - M-xylene - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Imidazolinone - 2-imidazoline - Carboxamide group - Isothiourea - Secondary carboxylic acid amide - Carboximidamide - Organic 1,3-dipolar compound - Amidine - Azacycle - Carboxylic acid amidine - Sulfenyl compound - Propargyl-type 1,3-dipolar organic compound - Ether - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Carbonyl group - Organonitrogen compound - Hydrocarbon derivative - 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