Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(C=C1)C1=NC(=C(N1)C1=CC=CC=C1)C1=CC2=C(C=C1)C1=C(S2)C=C(C=C1)C1=C(NC(=N1)C1=CC=C(OC)C=C1)C1=CC=CC=C1

InChIKey

InChIKey=RXNPLHXWGBRRAB-UHFFFAOYSA-N

Formula

C44H32N4O2S

Mass

680.83

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzothiophenes

Subclass

Dibenzothiophenes

Intermediate Tree Nodes

Not available

Direct Parent

Dibenzothiophenes

Alternative Parents

Phenylimidazoles 1-benzothiophenes Phenoxy compounds Methoxybenzenes Anisoles 2,4,5-trisubstituted imidazoles Alkyl aryl ethers Thiophenes Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Dibenzothiophene - 2-phenylimidazole - 5-phenylimidazole - 4-phenylimidazole - 1-benzothiophene - Phenoxy compound - Phenol ether - 2,4,5-trisubstituted-imidazole - Anisole - Trisubstituted imidazole - Methoxybenzene - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Imidazole - Thiophene - Azole - Heteroaromatic compound - Ether - Azacycle - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as dibenzothiophenes. These are organic heterocyclic compounds with a structure containing a dibenzothiophene moiety, made up of two benzene rings fused to a central thiophene ring.

External Descriptors

Not available

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