Compound Identification
SMILES
COC1=C(Cl)C=CC(CNC2=NN=C(N3CCC(O)CC3)C3=CC=CC=C23)=C1
InChIKey
InChIKey=PUFJBWXKQBRKFJ-UHFFFAOYSA-N
Formula
C21H23ClN4O2
Mass
398.89
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazanaphthalenes
-
Subclass
Benzodiazines
- Level 5 Phthalazines
-
Subclass
Benzodiazines
-
Class
Diazanaphthalenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazanaphthalenes
Subclass
Benzodiazines
Intermediate Tree Nodes
Not available
Direct Parent
Phthalazines
Alternative Parents
Phenoxy compounds Methoxybenzenes Anisoles Dialkylarylamines Benzylamines Alkyl aryl ethers Aminopyridazines Chlorobenzenes Piperidines Imidolactams Aryl chlorides Heteroaromatic compounds Secondary alcohols Azacyclic compounds Hydrocarbon derivatives Organochlorides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phthalazine - Phenoxy compound - Anisole - Benzylamine - Methoxybenzene - Dialkylarylamine - Phenol ether - Alkyl aryl ether - Aminopyridazine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Imidolactam - Benzenoid - Piperidine - Pyridazine - Heteroaromatic compound - Secondary alcohol - Azacycle - Ether - Organochloride - Organohalogen compound - Hydrocarbon derivative - Amine - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organopnictogen compound - Alcohol - 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