Structure Information
Structure

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

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Triazoles

Intermediate Tree Nodes

Phenyltriazoles

Direct Parent

Phenyl-1,2,4-triazoles

Alternative Parents

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

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