Structure Information
Structure

Compound Identification

SMILES

CCCCC1=NC(SC2=CC=CC=C2)=C(C=O)N1CC1=CC2=C(C=C1)C1[C@H]([C@@H](C2C2=CC=CC=C12)C1=NNN=N1)C1=NNN=N1

InChIKey

InChIKey=GUSBPFRBPYOVJM-RAWLKHAVSA-N

Formula

C33H30N10OS

Mass

614.73

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lignans, neolignans and related compounds

Class

Aryltetralin lignans

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Aryltetralin lignans

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-aryltetralin lignan - Anthracene - Diarylthioether - Tetralin - 1,2,4,5-tetrasubstituted imidazole - Aryl thioether - Thiophenol ether - Imidazole-4-carbonyl group - Aryl-aldehyde - Monocyclic benzene moiety - N-substituted imidazole - Vinylogous thioester - Benzenoid - Azole - Imidazole - Heteroaromatic compound - Tetrazole - Azacycle - Organoheterocyclic compound - Thioether - Sulfenyl compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Aldehyde - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as aryltetralin lignans. These are lignans with a structure based on the 1-phenyltetralin skeleton.

External Descriptors

Not available

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