Structure Information
Structure

Compound Identification

SMILES

O=C1NN=C(OCC2=NN=C(SCCN3CCCCC3)N2CC2=CC=CC=C2)C2=CC=CC=C12

InChIKey

InChIKey=UJLDUFKPQHPHCZ-UHFFFAOYSA-N

Formula

C25H28N6O2S

Mass

476.6

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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

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phthalazinone - Aryl thioether - Alkyl aryl ether - Alkylarylthioether - Pyridazinone - Monocyclic benzene moiety - Piperidine - Benzenoid - Pyridazine - Azole - Heteroaromatic compound - 1,2,4-triazole - Lactam - Tertiary aliphatic amine - Tertiary amine - Ether - Azacycle - Sulfenyl compound - Thioether - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Amine - Organic oxygen 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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