Compound Identification
SMILES
N#CC1=CSC(CN2CCCCC2C2=NC(=NO2)C2=CC=CC(=C2)C#N)=N1
InChIKey
InChIKey=SOQLQSYJDARMFJ-UHFFFAOYSA-N
Formula
C19H16N6OS
Mass
376.44
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Azoles
-
Subclass
Oxadiazoles
-
Level 5
1,2,4-oxadiazoles
- Level 6 Phenyloxadiazoles
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Level 5
1,2,4-oxadiazoles
-
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 2,4-disubstituted thiazoles Piperidines Heteroaromatic compounds Trialkylamines Oxacyclic compounds Nitriles Azacyclic compounds Organooxygen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenyl-1,2,4-oxadiazole - Benzonitrile - 2,4-disubstituted 1,3-thiazole - Aralkylamine - Monocyclic benzene moiety - Piperidine - Benzenoid - Heteroaromatic compound - Thiazole - Tertiary amine - Tertiary aliphatic amine - Carbonitrile - Nitrile - Oxacycle - Azacycle - Organonitrogen compound - Amine - Organic nitrogen compound - Cyanide - Organooxygen compound - Hydrocarbon derivative - 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