Compound Identification
SMILES
CC(=O)NC1=CC=CC(=C1)C1=CC(NC(=O)C2=CC=C(C=C2)C(C)(C)O)=NC2=CC=NN12
InChIKey
InChIKey=IRTOZPPWXFRTRM-UHFFFAOYSA-N
Formula
C24H23N5O3
Mass
429.48
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
Acetanilides Benzamides N-acetylarylamines Phenylpropanes Pyrazolo[1,5-a]pyrimidines Benzoyl derivatives Imidolactams Tertiary alcohols Heteroaromatic compounds Acetamides Pyrazoles Secondary carboxylic acid amides Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Aromatic alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
4-phenylpyrimidine - Acetanilide - Benzamide - Benzoic acid or derivatives - Phenylpropane - Pyrazolopyrimidine - Anilide - Pyrazolo[1,5-a]pyrimidine - N-acetylarylamine - N-arylamide - Benzoyl - Imidolactam - Benzenoid - Monocyclic benzene moiety - Acetamide - Tertiary alcohol - Azole - Pyrazole - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organonitrogen compound - Carbonyl group - Organooxygen compound - Alcohol - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic alcohol - 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