Compound Identification
SMILES
CN1C(NC2=C(Cl)C=CC=C2Cl)=NC2=C1C1=C(NC(=NC1=O)C1=CSC(=N1)[C@H]1CCCN1C(=O)OCC1=CC=CC=C1)C=C2
InChIKey
InChIKey=BZJRSONUDIAHGU-HSZRJFAPSA-N
Formula
C31H25Cl2N7O3S
Mass
646.55
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
Benzyloxycarbonyls Benzimidazoles Pyrrolidine carboxylic acids Aniline and substituted anilines Dichlorobenzenes 2,4-disubstituted thiazoles Pyrimidones Aminoimidazoles Aryl chlorides N-substituted imidazoles Carbamate esters Vinylogous amides Heteroaromatic compounds Azacyclic compounds Organic oxides Amines Organochlorides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzyloxycarbonyl - Quinazoline - Benzimidazole - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Aniline or substituted anilines - 1,3-dichlorobenzene - 2,4-disubstituted 1,3-thiazole - Pyrimidone - Halobenzene - Chlorobenzene - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Aminoimidazole - Pyrimidine - N-substituted imidazole - Azole - Heteroaromatic compound - Vinylogous amide - Carbamic acid ester - Thiazole - Pyrrolidine - Imidazole - Azacycle - Carbonyl group - Organic oxygen compound - Amine - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organooxygen compound - Organohalogen compound - Organochloride - Organonitrogen 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