Compound Identification
SMILES
CN(C1=CC=C(OC(F)(F)F)C=C1)C1=NC=NC(=C1)C1=CC(=CC=C1)C(=O)NCCOCCOCCOCCOCCOCCN
InChIKey
InChIKey=AHHOZJHJGPRLSL-UHFFFAOYSA-N
Formula
C31H40F3N5O7
Mass
651.684
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
Alkyldiarylamines Benzamides Phenoxy compounds Phenol ethers Aniline and substituted anilines Benzoyl derivatives Aminopyrimidines and derivatives Imidolactams Heteroaromatic compounds Secondary carboxylic acid amides Amino acids and derivatives Trihalomethanes Dialkyl ethers Azacyclic compounds Alkyl fluorides Monoalkylamines Organic oxides Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
4-phenylpyrimidine - Alkyldiarylamine - Benzamide - Benzoic acid or derivatives - Phenol ether - Phenoxy compound - Aniline or substituted anilines - Benzoyl - Aminopyrimidine - Benzenoid - Imidolactam - Monocyclic benzene moiety - Heteroaromatic compound - Amino acid or derivatives - Secondary carboxylic acid amide - Trihalomethane - Carboxamide group - Azacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Primary aliphatic amine - Organic nitrogen compound - Amine - Alkyl halide - Primary amine - Alkyl fluoride - Hydrocarbon derivative - Halomethane - Organic oxide - Organic oxygen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - 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