Compound Identification
SMILES
NC1=CC=CC2=C1C(=O)N(CCCCN1CCN(CC1)C1=NC=C(C=N1)C1=CC=CC=C1)C2=O
InChIKey
InChIKey=YYGXNHDBACCXGH-UHFFFAOYSA-N
Formula
C26H28N6O2
Mass
456.55
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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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 Phthalimides Isoindoles Dialkylarylamines Aminopyrimidines and derivatives N-alkylpiperazines N-substituted carboxylic acid imides Benzene and substituted derivatives Heteroaromatic compounds Vinylogous amides Amino acids and derivatives Trialkylamines Azacyclic compounds Primary amines Hydrocarbon derivatives Organic oxides Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
5-phenylpyrimidine - N-arylpiperazine - Phthalimide - Isoindolone - Isoindoline - Isoindole - Isoindole or derivatives - Dialkylarylamine - Aminopyrimidine - N-alkylpiperazine - Benzenoid - Monocyclic benzene moiety - 1,4-diazinane - Carboxylic acid imide, n-substituted - Piperazine - Vinylogous amide - Carboxylic acid imide - Heteroaromatic compound - Tertiary amine - Tertiary aliphatic amine - Amino acid or derivatives - Carboxylic acid derivative - Azacycle - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Amine - Primary 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