Compound Identification
SMILES
CC1=NC=C2CN3CCN(CC4=C(CCCC(F)(F)F)C=CC(OC5=C(C=CC(CN12)=C5)C#N)=C4)C(=O)C3
InChIKey
InChIKey=CNXFDDURKHKEMI-UHFFFAOYSA-N
Formula
C28H28F3N5O2
Mass
523.56
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Ethers
- Level 5 Diarylethers
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Subclass
Ethers
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Ethers
Intermediate Tree Nodes
Not available
Direct Parent
Diarylethers
Alternative Parents
Alpha amino acids and derivatives Aralkylamines N-alkylpiperazines Benzenoids N-substituted imidazoles Tertiary carboxylic acid amides Heteroaromatic compounds Trialkylamines Lactams Azacyclic compounds Oxacyclic compounds Nitriles Hydrocarbon derivatives Organic oxides Carbonyl compounds Organofluorides Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Diaryl ether - Alpha-amino acid or derivatives - Aralkylamine - N-alkylpiperazine - 1,4-diazinane - N-substituted imidazole - Piperazine - Benzenoid - Azole - Heteroaromatic compound - Imidazole - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Lactam - Tertiary amine - Tertiary aliphatic amine - Organoheterocyclic compound - Nitrile - Carbonitrile - Azacycle - Carboxylic acid derivative - Oxacycle - Alkyl fluoride - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Alkyl halide - Carbonyl group - Cyanide - Organofluoride - Organonitrogen compound - Organohalogen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as diarylethers. These are organic compounds containing the dialkyl ether functional group, with the formula ROR', where R and R' are aryl groups.
External Descriptors
Not available