Compound Identification
SMILES
CC(=O)NC[C@H]1CN(C(=O)O1)C1=CC(F)=C(C=C1)C1=CN=C(N=C1)C1=NOC(CO)C1
InChIKey
InChIKey=IZZKEJBXYZBPSE-LOACHALJSA-N
Formula
C20H20FN5O5
Mass
429.408
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
Fluorobenzenes Oxazolidinones Aryl fluorides Acetamides Carbamate esters Heteroaromatic compounds Isoxazolines Secondary carboxylic acid amides Oxacyclic compounds Azacyclic compounds Organofluorides Carbonyl compounds Organonitrogen compounds Primary alcohols Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
5-phenylpyrimidine - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Oxazolidinone - Benzenoid - Heteroaromatic compound - Isoxazoline - Oxazolidine - Carbamic acid ester - Acetamide - Secondary carboxylic acid amide - Carboxamide group - Oxacycle - Azacycle - Carboxylic acid derivative - Organic oxide - Organohalogen compound - Alcohol - Hydrocarbon derivative - Organofluoride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Primary alcohol - Organic nitrogen compound - Organic oxygen 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