Compound Identification
SMILES
COC1=CC=CC(=N1)C1=C(C=CC(F)=C1)[C@@H]1N=C(NOCC2NCC(O)C2O)C2=C(N=C(N)N=C2C)C1(F)F
InChIKey
InChIKey=MRSCUMUDAOXUQF-XTDSXPLLSA-N
Formula
C25H26F3N7O4
Mass
545.523
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyridines and derivatives
- Subclass Phenylpyridines
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Class
Pyridines and derivatives
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Phenylpyridines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyridines
Alternative Parents
Pyridopyrimidines Alkyl aryl ethers Aminopyrimidines and derivatives Fluorobenzenes Imidolactams Aryl fluorides Pyrrolidines Heteroaromatic compounds Secondary alcohols 1,2-aminoalcohols 1,2-diols Propargyl-type 1,3-dipolar organic compounds Amidines Dialkylamines Azacyclic compounds Primary amines Hydrocarbon derivatives Organofluorides Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyridine - Pyridopyrimidine - Fluorobenzene - Halobenzene - Alkyl aryl ether - Aminopyrimidine - Monocyclic benzene moiety - Aryl halide - Aryl fluoride - Imidolactam - Pyrimidine - Benzenoid - Heteroaromatic compound - Pyrrolidine - 1,2-diol - 1,2-aminoalcohol - Secondary alcohol - Secondary aliphatic amine - Amidine - Azacycle - Secondary amine - Ether - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Amine - Primary amine - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - Alcohol - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyridines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyridine ring through a CC or CN bond.
External Descriptors
Not available