Structure Information
Structure

Compound Identification

SMILES

C1CN=C(NC2=CC=CC3=C2CCCC3)N1.CN1CCCC(CC1)N1N=C(CC2=CC=C(Cl)C=C2)C2=CC=CC=C2C1=O

InChIKey

InChIKey=GMJXEJKWYVCYTM-UHFFFAOYSA-N

Formula

C35H41ClN6O

Mass

597.2

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazanaphthalenes

Subclass

Benzodiazines

Intermediate Tree Nodes

Phthalazines

Direct Parent

Phthalazinones

Alternative Parents

Tetralins Pyridazinones Azepanes Chlorobenzenes Aryl chlorides Heteroaromatic compounds Imidazolines Lactams Trialkylamines Guanidines Azacyclic compounds Carboximidamides Propargyl-type 1,3-dipolar organic compounds Hydrocarbon derivatives Organooxygen compounds Organic oxides Organochlorides

Molecular Framework

Not available

Substituents

Phthalazinone - Tetralin - Azepane - Chlorobenzene - Halobenzene - Pyridazinone - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyridazine - Benzenoid - Heteroaromatic compound - 2-imidazoline - Tertiary amine - Tertiary aliphatic amine - Guanidine - Lactam - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Hydrocarbon derivative - Organohalogen compound - Organic oxide - Organochloride - Organic oxygen compound - Amine - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phthalazinones. These are compounds containing a phthalazine bearing a ketone group.

External Descriptors

Not available

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