Compound Identification
SMILES
FC(F)(F)OC1=CC=C(NC(=O)CN2C=NC(=CC2=O)C2=CC=C(Cl)C=C2)C=C1
InChIKey
InChIKey=ZKTYXVMCVXJZRM-UHFFFAOYSA-N
Formula
C19H13ClF3N3O3
Mass
423.78
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
Anilides Phenoxy compounds Phenol ethers N-arylamides Pyrimidones Chlorobenzenes Aryl chlorides Hydropyrimidines Heteroaromatic compounds Trihalomethanes Secondary carboxylic acid amides Lactams Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides Organofluorides Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
4-phenylpyrimidine - Anilide - Phenol ether - Phenoxy compound - N-arylamide - Pyrimidone - Halobenzene - Chlorobenzene - Hydropyrimidine - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Heteroaromatic compound - Trihalomethane - Secondary carboxylic acid amide - Lactam - Carboxamide group - Carboxylic acid derivative - Azacycle - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Alkyl halide - Hydrocarbon derivative - Alkyl fluoride - Halomethane - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organochloride - Organofluoride - 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