Compound Identification
SMILES
FC1=C(C=CC(CN2C[C@@H]3C[C@H]2CO3)=C1)C1=CC=NC2=C(C(=NN12)C1=CC=NC=C1)C1=C2C=NNC2=CC=C1
InChIKey
InChIKey=UEMMXLHHQNSAQG-SFTDATJTSA-N
Formula
C30H24FN7O
Mass
517.568
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
Pyrazolo[1,5-a]pyrimidines Indazoles Phenylmethylamines Benzylamines Aralkylamines Fluorobenzenes Pyridines and derivatives Aryl fluorides N-alkylpyrrolidines Morpholines Pyrazoles Oxolanes Heteroaromatic compounds Trialkylamines Oxacyclic compounds Dialkyl ethers Azacyclic compounds Hydrocarbon derivatives Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
4-phenylpyrimidine - Pyrazolo[1,5-a]pyrimidine - Pyrazolopyrimidine - Benzopyrazole - Indazole - Phenylmethylamine - Benzylamine - Fluorobenzene - Aralkylamine - Halobenzene - N-alkylpyrrolidine - Benzenoid - Morpholine - Pyridine - Monocyclic benzene moiety - Oxazinane - Aryl halide - Aryl fluoride - Azole - Heteroaromatic compound - Pyrrolidine - Pyrazole - Oxolane - Tertiary amine - Tertiary aliphatic amine - Azacycle - Ether - Dialkyl ether - Oxacycle - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - 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