Structure Information
Structure

Compound Identification

SMILES

CN1N=CC=C1C1=NN=C(N2CCC(CC2)NC(=O)NC2=C(C=C(F)C=C2)C(F)(F)F)C2=CC=CC=C12

InChIKey

InChIKey=VUKMBNGMZOGJJG-UHFFFAOYSA-N

Formula

C25H23F4N7O

Mass

513.501

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazanaphthalenes

Subclass

Benzodiazines

Intermediate Tree Nodes

Not available

Direct Parent

Phthalazines

Alternative Parents

Trifluoromethylbenzenes N-phenylureas Dialkylarylamines Aminopyridazines Fluorobenzenes Piperidines Aryl fluorides Imidolactams Pyrazoles Heteroaromatic compounds Ureas Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides Alkyl fluorides

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Trifluoromethylbenzene - N-phenylurea - Phthalazine - Dialkylarylamine - Aminopyridazine - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Piperidine - Pyridazine - Benzenoid - Imidolactam - Heteroaromatic compound - Pyrazole - Azole - Urea - Azacycle - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Amine - Organohalogen compound - Organic nitrogen compound - Organofluoride - Organonitrogen compound - Alkyl fluoride - Alkyl halide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phthalazines. These are compounds containing a phthalazine moiety, which consists of a benzene ring fused to a pyridazine, forming a 2,3-benzodiazine skeleton.

External Descriptors

Not available

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