Compound Identification
SMILES
N#CC1=CN=C2N1N=C(NC1=CC(=CC(=C1)N1C=NC=N1)N1C=NC=N1)C=C2NC1CC1
InChIKey
InChIKey=IQKVYNRBNSHLMM-UHFFFAOYSA-N
Formula
C20H16N12
Mass
424.432
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Azoles
-
Subclass
Triazoles
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Level 5
Phenyltriazoles
- Level 6 Phenyl-1,2,4-triazoles
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Level 5
Phenyltriazoles
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Subclass
Triazoles
-
Class
Azoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Triazoles
Intermediate Tree Nodes
Phenyltriazoles
Direct Parent
Phenyl-1,2,4-triazoles
Alternative Parents
Aniline and substituted anilines Secondary alkylarylamines Aminopyridazines N-substituted imidazoles Imidolactams Heteroaromatic compounds Nitriles Azacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenyl-1,2,4-triazole - Aniline or substituted anilines - Aminopyridazine - Secondary aliphatic/aromatic amine - Imidolactam - Benzenoid - Monocyclic benzene moiety - Pyridazine - N-substituted imidazole - Heteroaromatic compound - Imidazole - Azacycle - Secondary amine - Nitrile - Carbonitrile - Hydrocarbon derivative - Organonitrogen compound - Amine - Organic nitrogen compound - Cyanide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenyl-1,2,4-triazoles. These are organic compounds containing a 1,2,4-triazole substituted by a phenyl group.
External Descriptors
Not available