Compound Identification
SMILES
CCOC(=O)N1CCN(CC2=NOC(=N2)C2=CC(OC)=CC=C2)CC1
InChIKey
InChIKey=VPMQKEFAYBWXCQ-UHFFFAOYSA-N
Formula
C17H22N4O4
Mass
346.387
Taxonomic Classification
Taxonomy Tree
-
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
Piperazine carboxylic acids Phenoxy compounds Methoxybenzenes Anisoles N-alkylpiperazines Aralkylamines Alkyl aryl ethers Heteroaromatic compounds Carbamate esters Trialkylamines Oxacyclic compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenyl-1,2,4-oxadiazole - Piperazine-1-carboxylic acid - Methoxybenzene - Phenoxy compound - Anisole - Phenol ether - N-alkylpiperazine - Aralkylamine - Alkyl aryl ether - Benzenoid - Piperazine - Monocyclic benzene moiety - 1,4-diazinane - Carbamic acid ester - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Ether - Oxacycle - Azacycle - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organooxygen compound - Amine - Organic oxygen 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