Structure Information
Structure

Compound Identification

SMILES

CCC1=CC=CC(CC)=C1NC(=O)CSC1=NN=C(O1)C1=NN(CC2=CC=CC=C2)C(=O)C2=CC=CC=C12

InChIKey

InChIKey=NYLAYMWDPZWLLG-UHFFFAOYSA-N

Formula

C29H27N5O3S

Mass

525.63

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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

Anilides N-arylamides Pyridazinones Alkylarylthioethers Heteroaromatic compounds 1,3,4-oxadiazoles Secondary carboxylic acid amides Lactams Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phthalazinone - Anilide - Aryl thioether - N-arylamide - Pyridazinone - Alkylarylthioether - Monocyclic benzene moiety - Pyridazine - Benzenoid - 1,3,4-oxadiazole - Azole - Oxadiazole - Heteroaromatic compound - Carboxamide group - Lactam - Secondary carboxylic acid amide - Azacycle - Oxacycle - Carboxylic acid derivative - Thioether - Sulfenyl compound - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Organopnictogen compound - 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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