Compound Identification
SMILES
COCCN(CC(=O)N1CCCCC1C1=NC(=NO1)C1=CC=C(Cl)C=C1)C(=O)NC1=CC=CC(=C1)C(F)(F)F
InChIKey
InChIKey=PWBJQIABQZZZJV-UHFFFAOYSA-N
Formula
C26H27ClF3N5O4
Mass
565.98
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Azoles
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Subclass
Oxadiazoles
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Level 5
1,2,4-oxadiazoles
- Level 6 Phenyloxadiazoles
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Level 5
1,2,4-oxadiazoles
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Subclass
Oxadiazoles
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Class
Azoles
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Oxadiazoles
Intermediate Tree Nodes
1,2,4-oxadiazoles
Direct Parent
Phenyloxadiazoles
Alternative Parents
Trifluoromethylbenzenes Alpha amino acids and derivatives N-phenylureas N-acylpiperidines Chlorobenzenes Aryl chlorides Tertiary carboxylic acid amides Heteroaromatic compounds Ureas Oxacyclic compounds Azacyclic compounds Dialkyl ethers Hydrocarbon derivatives Organic oxides Carbonyl compounds Organochlorides Organofluorides Organonitrogen compounds Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenyl-1,2,4-oxadiazole - Alpha-amino acid or derivatives - Trifluoromethylbenzene - N-phenylurea - N-acyl-piperidine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Piperidine - Heteroaromatic compound - Tertiary carboxylic acid amide - Carboxamide group - Urea - Oxacycle - Carboxylic acid derivative - Azacycle - Dialkyl ether - Ether - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organochloride - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenyloxadiazoles. These are polycyclic aromatic compounds containing a benzene ring linked to a 1,2,4-oxadiazole ring through a CC or CN bond.
External Descriptors
Not available