Compound Identification
SMILES
CCCCC(SC1=NC2=CC=CC(C)=C2C(=O)N1C1=CC(Cl)=CC=C1)C(=O)N1CCC(CC1)C(N)=O
InChIKey
InChIKey=IUJIPOBUJIZKQO-UHFFFAOYSA-N
Formula
C27H31ClN4O3S
Mass
527.08
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
Piperidinecarboxamides N-acylpiperidines Alkylarylthioethers Pyrimidones Chlorobenzenes Aryl chlorides Tertiary carboxylic acid amides Heteroaromatic compounds Tertiary amines Amino acids and derivatives Primary carboxylic acid amides Lactams Sulfenyl compounds Azacyclic compounds Carbonyl compounds Organochlorides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinazoline - N-acyl-piperidine - Piperidinecarboxamide - Aryl thioether - Chlorobenzene - Halobenzene - Pyrimidone - Alkylarylthioether - Benzenoid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Piperidine - Pyrimidine - Heteroaromatic compound - Tertiary carboxylic acid amide - Tertiary amine - Carboxamide group - Amino acid or derivatives - Lactam - Primary carboxylic acid amide - Thioether - Azacycle - Carboxylic acid derivative - Sulfenyl compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic nitrogen compound - Amine - Carbonyl group - Organic oxide - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Hydrocarbon derivative - 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