Compound Identification
SMILES
CN1C=CN=C1CN1CCCCC1C1=NC(=NO1)C1=CC=CC(=C1)C#N
InChIKey
InChIKey=JIBUTDVYQQSKNJ-UHFFFAOYSA-N
Formula
C19H20N6O
Mass
348.41
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
-
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
Benzonitriles Aralkylamines Piperidines N-substituted imidazoles Heteroaromatic compounds Trialkylamines Oxacyclic compounds Nitriles Azacyclic compounds Organooxygen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenyl-1,2,4-oxadiazole - Benzonitrile - Aralkylamine - Monocyclic benzene moiety - N-substituted imidazole - Piperidine - Benzenoid - Imidazole - Heteroaromatic compound - Tertiary amine - Tertiary aliphatic amine - Oxacycle - Nitrile - Carbonitrile - Azacycle - Amine - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Cyanide - Organic oxygen compound - Organic nitrogen 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