Compound Identification
SMILES
NC1=NC(=CC(=N1)C1=CC=C(Cl)C=C1)C1=CC=C(NC2=C3C=CC(Cl)=CC3=NC=C2)C=C1
InChIKey
InChIKey=IRDYDNAYNZMPLS-UHFFFAOYSA-N
Formula
C25H17Cl2N5
Mass
458.35
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazines
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Subclass
Pyrimidines and pyrimidine derivatives
- Level 5 Phenylpyrimidines
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Subclass
Pyrimidines and pyrimidine derivatives
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Class
Diazines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazines
Subclass
Pyrimidines and pyrimidine derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrimidines
Alternative Parents
Chloroquinolines 4-aminoquinolines Aniline and substituted anilines Chlorobenzenes Aminopyrimidines and derivatives Aminopyridines and derivatives Primary aromatic amines Aryl chlorides Heteroaromatic compounds Secondary amines Azacyclic compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
4-phenylpyrimidine - 4-aminoquinoline - Haloquinoline - Aminoquinoline - Chloroquinoline - Quinoline - Aniline or substituted anilines - Aminopyridine - Aminopyrimidine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Primary aromatic amine - Pyridine - Heteroaromatic compound - Azacycle - Secondary amine - Organohalogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organochloride - Organonitrogen compound - Primary amine - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrimidines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrimidine ring through a CC or CN bond. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.
External Descriptors
Not available