Compound Identification
SMILES
CN(C)[C@H](CNC1=NC(C2=CC=NC=C2)=C(C2=CC(C)=CC=C2)C(=O)N1C)CC1=CC=CC=C1
InChIKey
InChIKey=DBAJRWZVGSJNQW-DEOSSOPVSA-N
Formula
C28H31N5O
Mass
453.59
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
Amphetamines and derivatives Toluenes Pyrimidones Aralkylamines Aminopyrimidines and derivatives Pyridines and derivatives Hydropyrimidines Heteroaromatic compounds Trialkylamines Lactams Azacyclic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
5-phenylpyrimidine - Amphetamine or derivatives - Aminopyrimidine - Pyrimidone - Toluene - Aralkylamine - Benzenoid - Monocyclic benzene moiety - Hydropyrimidine - Pyridine - Heteroaromatic compound - Tertiary aliphatic amine - Lactam - Tertiary amine - Azacycle - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Amine - Aromatic heteromonocyclic 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