Structure Information
Structure

Compound Identification

SMILES

CC(C)(C)C1=CC=C(NC2=NN=C3C=C(C=NN23)C2=C(C=CC=N2)C(F)(F)F)C=C1

InChIKey

InChIKey=UWUAWQLYCCMNOZ-UHFFFAOYSA-N

Formula

C21H19F3N6

Mass

412.42

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Triazolopyridazines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Triazolopyridazines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phenylpropane - Triazolopyridazine - Aniline or substituted anilines - Monocyclic benzene moiety - Pyridazine - Pyridine - Benzenoid - 1,2,4-triazole - Azole - Heteroaromatic compound - Secondary amine - Azacycle - Amine - Alkyl halide - Organic nitrogen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl fluoride - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as triazolopyridazines. These are polycyclic compounds containing a triazole fused to a pyridazine. Triazole is a five-membered ring consisting of two carbon atoms and three nitrogen atoms. Pyridazine is a six-membered aromatic ring with two adjacent nitrogen atoms, and for carbon atoms.

External Descriptors

Not available

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