Structure Information
Structure

Compound Identification

SMILES

[Be++].CCOC1=CC2=C(C=C1)N=C(S2)S([NH-])(=O)=O.CCOC1=CC2=C(C=C1)N=C(S2)S([NH-])(=O)=O

InChIKey

InChIKey=XMSAPMBBNFADTJ-UHFFFAOYSA-N

Formula

C18H18BeN4O6S4

Mass

523.62

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzothiazoles

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzothiazoles

Alternative Parents

Molecular Framework

Not available

Substituents

1,3-benzothiazole - Phenol ether - Alkyl aryl ether - Benzenoid - Azole - Organic sulfonic acid or derivatives - Heteroaromatic compound - Organosulfonic acid or derivatives - Sulfonyl - Thiazole - Organic beryllium salt - Ether - Azacycle - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - Organic salt - Organic zwitterion - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzothiazoles. These are organic compounds containing a benzene fused to a thiazole ring (a five-membered ring with four carbon atoms, one nitrogen atom and one sulfur atom).

External Descriptors

Not available

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