Compound Identification
SMILES
CCC1=C(N)C(Cl)=CC(C[C@@H](OC(=O)N2CCC(CC2)N2CC3=CC=CC=C3NC2=O)C(=O)N2CCC(CC2)N2CCN(C)CC2)=C1
InChIKey
InChIKey=KVRSNAFSMBVUGD-WJOKGBTCSA-N
Formula
C35H48ClN7O4
Mass
666.26
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
Piperidinecarboxylic acids N-acylpiperidines Aniline and substituted anilines Aminopiperidines Pyrimidones Chlorobenzenes N-methylpiperazines Aryl chlorides Tertiary carboxylic acid amides Carbamate esters Trialkylamines Ureas Azacyclic compounds Hydrocarbon derivatives Primary amines Carbonyl compounds Organochlorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinazoline - Piperidinecarboxylic acid - N-acyl-piperidine - Aniline or substituted anilines - 4-aminopiperidine - Pyrimidone - Halobenzene - N-methylpiperazine - N-alkylpiperazine - Chlorobenzene - 1,4-diazinane - Piperazine - Aryl halide - Pyrimidine - Piperidine - Benzenoid - Monocyclic benzene moiety - Aryl chloride - Tertiary carboxylic acid amide - Carbamic acid ester - Amino acid or derivatives - Carboxamide group - Urea - Tertiary aliphatic amine - Tertiary amine - Azacycle - Carboxylic acid derivative - Organic oxygen compound - Organic nitrogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Primary amine - 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