Compound Identification
SMILES
CCC1=CC=CC=C1C1=NC(=NO1)[C@@H]1CCCN1C(=O)C1=CC(OC)=C(Cl)C=C1N1N=CC=N1
InChIKey
InChIKey=FEQYQBGREABPNL-IBGZPJMESA-N
Formula
C24H23ClN6O3
Mass
478.94
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
Phenyl-1,2,3-triazoles 4-halobenzoic acids and derivatives Benzamides Methoxyanilines N-acylpyrrolidines Methoxybenzenes Benzoyl derivatives Anisoles Phenoxy compounds Alkyl aryl ethers Chlorobenzenes Aryl chlorides Heteroaromatic compounds Tertiary carboxylic acid amides Azacyclic compounds Oxacyclic compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenyltriazole - Phenyl-1,2,4-oxadiazole - Phenyl-1,2,3-triazole - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Methoxyaniline - Benzoic acid or derivatives - Benzamide - N-acylpyrrolidine - Methoxybenzene - Phenol ether - Anisole - Phenoxy compound - Benzoyl - Alkyl aryl ether - Chlorobenzene - Halobenzene - Benzenoid - Aryl chloride - Monocyclic benzene moiety - Aryl halide - Heteroaromatic compound - 1,2,3-triazole - Triazole - Tertiary carboxylic acid amide - Pyrrolidine - Carboxamide group - Ether - Carboxylic acid derivative - Azacycle - Oxacycle - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - 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