Structure Information
Structure

Compound Identification

SMILES

CS(=O)(=O)CCCN1N=C(C(=O)NCC2=CC=C(Cl)C=C2)C(=O)C2=C1C=CC(CN1CCOCC1)=C2

InChIKey

InChIKey=PESYDWOLBHBIGV-UHFFFAOYSA-N

Formula

C25H29ClN4O5S

Mass

533.04

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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

Cinnolines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Cinnoline - 2-heteroaryl carboxamide - Chlorobenzene - Halobenzene - Aralkylamine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Morpholine - Oxazinane - Benzenoid - Pyridazine - Heteroaromatic compound - Vinylogous amide - Sulfone - Sulfonyl - Tertiary aliphatic amine - Amino acid or derivatives - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid derivative - Dialkyl ether - Azacycle - Oxacycle - Ether - Organosulfur compound - Organohalogen compound - Amine - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cinnolines. These are organic aromatic compounds containing a benzene fused to a pyridazine ring.

External Descriptors

Not available

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