Compound Identification
SMILES
CC(OC1=C(C=C(C=C1)C1=NC(=NO1)C1=C(N)N=CC=C1)C#N)C(F)(F)F
InChIKey
InChIKey=RFBNDWFEIDGGTH-UHFFFAOYSA-N
Formula
C17H12F3N5O2
Mass
375.311
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
Phenoxy compounds Phenol ethers Benzonitriles Aminopyridines and derivatives Alkyl aryl ethers Primary aromatic amines Imidolactams Heteroaromatic compounds Oxacyclic compounds Nitriles Azacyclic compounds Organopnictogen compounds Organofluorides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenyl-1,2,4-oxadiazole - Benzonitrile - Phenol ether - Phenoxy compound - Aminopyridine - Alkyl aryl ether - Monocyclic benzene moiety - Primary aromatic amine - Pyridine - Benzenoid - Imidolactam - Heteroaromatic compound - Oxacycle - Azacycle - Ether - Carbonitrile - Nitrile - Hydrocarbon derivative - Organonitrogen compound - Organofluoride - Organohalogen compound - Organooxygen compound - Alkyl fluoride - Primary amine - Organic nitrogen compound - Alkyl halide - Cyanide - Organic oxygen compound - Organopnictogen compound - Amine - 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