Compound Identification
SMILES
COC1=C(Cl)C=C(CNC2=NN=C(N3CCC(N)CC3)C3=C2C=CC(=C3)C#N)C=C1
InChIKey
InChIKey=CFQOXGKVNOTCMK-UHFFFAOYSA-N
Formula
C22H23ClN6O
Mass
422.92
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
-
Class
Diazanaphthalenes
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Subclass
Benzodiazines
- Level 5 Phthalazines
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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
Phthalazines
Alternative Parents
Anisoles Benzylamines Dialkylarylamines Methoxybenzenes Phenoxy compounds Aminopyridazines Chlorobenzenes Aminopiperidines Alkyl aryl ethers Imidolactams Aryl chlorides Heteroaromatic compounds Azacyclic compounds Nitriles Hydrocarbon derivatives Monoalkylamines Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phthalazine - Anisole - Benzylamine - Phenol ether - Dialkylarylamine - Methoxybenzene - Phenoxy compound - Alkyl aryl ether - Aminopyridazine - 4-aminopiperidine - Chlorobenzene - Halobenzene - Imidolactam - Benzenoid - Pyridazine - Piperidine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Azacycle - Ether - Carbonitrile - Nitrile - Organic oxygen compound - Organochloride - Amine - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Primary amine - Organohalogen compound - Primary aliphatic amine - Cyanide - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phthalazines. These are compounds containing a phthalazine moiety, which consists of a benzene ring fused to a pyridazine, forming a 2,3-benzodiazine skeleton.
External Descriptors
Not available