Compound Identification
SMILES
CCC(C)N1C(=O)C2=C(N=CN2C2=C1C(C#N)=C(F)C=C2)C1=NOC(=N1)C1=CC=C(F)C=C1
InChIKey
InChIKey=BFWNGHZVUXGQEJ-UHFFFAOYSA-N
Formula
C23H16F2N6O2
Mass
446.418
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
-
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
Quinoxalines Imidazo[1,5-a]pyrazines Fluorobenzenes Pyrazines N-substituted imidazoles Aryl fluorides Heteroaromatic compounds Lactams Oxacyclic compounds Nitriles Azacyclic compounds Organooxygen compounds Organofluorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenyl-1,2,4-oxadiazole - Quinoxaline - Imidazo[1,5-a]pyrazine - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - N-substituted imidazole - Pyrazine - Benzenoid - Heteroaromatic compound - Imidazole - Lactam - Carbonitrile - Nitrile - Oxacycle - Azacycle - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Aromatic heteropolycyclic 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