Structure Information
Structure

Compound Identification

SMILES

[Cl-].CN(CCC[N+]1(C)CC[C@H](C1)OC(=O)C(O)(C1CCCCC1)C1=CC=CO1)C1=CC=CC=C1.C[N+]1(CCCOC2=NC3=CC=CC=C3S2)CCC(C1)OC(=O)C(O)(C1CCCCC1)C1=CC=CO1

InChIKey

InChIKey=GDCRRZYBCVUNHY-CRXBLQIWSA-M

Formula

C54H74ClN4O9S

Mass

990.71

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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 - Dialkylarylamine - Aniline or substituted anilines - Alkyl aryl ether - Monocyclic benzene moiety - N-alkylpyrrolidine - Benzenoid - Azole - Furan - Pyrrolidine - Quaternary ammonium salt - Tertiary alcohol - Thiazole - Tetraalkylammonium salt - Heteroaromatic compound - Tertiary amine - Amino acid or derivatives - Carboxylic acid ester - Azacycle - Oxacycle - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Aromatic alcohol - Organic chloride salt - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Amine - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Organic salt - Organic oxide - Alcohol - Organic cation - 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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