Compound Identification
SMILES
CCCN1C(=O)N(CCN2CCN(CC2)C2=CC=CC3=CC=CC=C23)C(=O)C=C1C1=CC=CC=C1
InChIKey
InChIKey=PCAIUSCRKWAQOP-UHFFFAOYSA-N
Formula
C29H32N4O2
Mass
468.601
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
N-arylpiperazines Naphthalenes Dialkylarylamines N-alkylpiperazines Pyrimidones Hydropyrimidines Benzene and substituted derivatives Heteroaromatic compounds Vinylogous amides Trialkylamines Ureas Lactams Azacyclic compounds Organic oxides Hydrocarbon derivatives Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
4-phenylpyrimidine - N-arylpiperazine - Naphthalene - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Pyrimidone - N-alkylpiperazine - Monocyclic benzene moiety - 1,4-diazinane - Hydropyrimidine - Piperazine - Benzenoid - Heteroaromatic compound - Vinylogous amide - Urea - Lactam - Tertiary amine - Tertiary aliphatic amine - Azacycle - Amine - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - 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