Compound Identification
SMILES
OC(=O)C(F)(F)F.CC(C)OC1=C(C=C(C=C1)C1=NC(=NO1)C1=C(C)C2=C(CNCC2)C=C1)C#N
InChIKey
InChIKey=RAFOQWOWKFNMPW-UHFFFAOYSA-N
Formula
C24H23F3N4O4
Mass
488.467
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Azoles
-
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
Tetrahydroisoquinolines Phenoxy compounds Phenol ethers Benzonitriles Alkyl aryl ethers Aralkylamines Alpha-halocarboxylic acids Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Nitriles Carboxylic acids Dialkylamines Monocarboxylic acids and derivatives Carbonyl compounds Organic oxides Alkyl fluorides Organofluorides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Phenyl-1,2,4-oxadiazole - Tetrahydroisoquinoline - Phenoxy compound - Phenol ether - Benzonitrile - Alkyl aryl ether - Aralkylamine - Benzenoid - Monocyclic benzene moiety - Alpha-halocarboxylic acid or derivatives - Alpha-halocarboxylic acid - Heteroaromatic compound - Azacycle - Carbonitrile - Monocarboxylic acid or derivatives - Secondary amine - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Ether - Nitrile - Oxacycle - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Amine - Cyanide - Organic oxygen compound - Alkyl halide - Alkyl fluoride - 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