Compound Identification
SMILES
FC(F)(F)C1=CC(=CC(=C1)C(=O)NC1=NC=CC(=N1)C1=CN=CC=C1)N1CCOCC1
InChIKey
InChIKey=CQTRPFZHDKPNLQ-UHFFFAOYSA-N
Formula
C21H18F3N5O2
Mass
429.403
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 Pyridinylpyrimidines
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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
Pyridinylpyrimidines
Alternative Parents
Phenylmorpholines Trifluoromethylbenzenes Aminobenzoic acids and derivatives Benzamides Aniline and substituted anilines Dialkylarylamines Benzoyl derivatives Pyridines and derivatives Heteroaromatic compounds Secondary carboxylic acid amides Amino acids and derivatives Oxacyclic compounds Azacyclic compounds Dialkyl ethers Organic oxides Alkyl fluorides Hydrocarbon derivatives Organofluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylmorpholine - Pyridinylpyrimidine - Aminobenzoic acid or derivatives - Trifluoromethylbenzene - Benzamide - Benzoic acid or derivatives - Benzoyl - Dialkylarylamine - Aniline or substituted anilines - Benzenoid - Pyridine - Monocyclic benzene moiety - Oxazinane - Morpholine - Heteroaromatic compound - Amino acid or derivatives - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Oxacycle - Azacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Amine - Organooxygen compound - Alkyl fluoride - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Alkyl halide - Organic nitrogen compound - Organonitrogen compound - Organohalogen compound - Organofluoride - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyridinylpyrimidines. These are compounds containing a pyridinylpyrimidine skeleton, which consists of a pyridine linked (not fused) to a pyrimidine by a bond.
External Descriptors
Not available