Compound Identification
SMILES
COC1=CC=C(C=C1)C1=NOC(=N1)C1=C(N)N(N=N1)C1=CC(Cl)=C(F)C=C1
InChIKey
InChIKey=XFYHEKZTDUOAEQ-UHFFFAOYSA-N
Formula
C17H12ClFN6O2
Mass
386.77
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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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
Phenyl-1,2,3-triazoles Phenoxy compounds Anisoles Methoxybenzenes Alkyl aryl ethers Fluorobenzenes Chlorobenzenes Primary aromatic amines Aryl chlorides Aryl fluorides Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organochlorides Organofluorides Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenyltriazole - Phenyl-1,2,3-triazole - Phenyl-1,2,4-oxadiazole - Anisole - Phenol ether - Phenoxy compound - Methoxybenzene - Alkyl aryl ether - Chlorobenzene - Fluorobenzene - Halobenzene - Aryl chloride - Aryl fluoride - Aryl halide - Benzenoid - Monocyclic benzene moiety - Primary aromatic amine - Heteroaromatic compound - 1,2,3-triazole - Triazole - Ether - Azacycle - Oxacycle - Organofluoride - Organochloride - Organohalogen compound - Primary amine - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organopnictogen compound - Organonitrogen compound - Organooxygen 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