Structure Information
Structure

Compound Identification

SMILES

O.OC(=O)C(O)=O.CC(C)OC1=NC2=C(S1)C=C(NC(C)CN1CCN(CCC3=CC=CC=C3)CC1)C=C2

InChIKey

InChIKey=PKRLUIYNCRRWMJ-UHFFFAOYSA-N

Formula

C27H38N4O6S

Mass

546.68

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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 - Phenethylamine - Alkyl aryl ether - Secondary aliphatic/aromatic amine - N-alkylpiperazine - Aralkylamine - Monocyclic benzene moiety - 1,4-diazinane - Dicarboxylic acid or derivatives - Piperazine - Benzenoid - Azole - Heteroaromatic compound - Thiazole - Tertiary amine - Tertiary aliphatic amine - Secondary amine - Azacycle - Ether - Carboxylic acid derivative - Carboxylic acid - Hydrocarbon derivative - Amine - Carbonyl group - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Organic nitrogen compound - 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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