Structure Information
Structure

Compound Identification

SMILES

CCN1N=CC2=C1C=CC(=C2)C1=NC=CC(=C1)C1=NC2=C(S1)C(C1=CC=C(Cl)C=C1)=C([C@H](OC(C)(C)C)C(O)=O)C(C)=C2

InChIKey

InChIKey=ICTIHKQFFRWIAJ-PMERELPUSA-N

Formula

C34H31ClN4O3S

Mass

611.16

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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

Aromatic heteropolycyclic compounds

Substituents

Benzopyrazole - 1,3-benzothiazole - Indazole - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyridine - Azole - Heteroaromatic compound - Thiazole - Pyrazole - Azacycle - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organooxygen compound - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Organochloride - Organohalogen 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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