Structure Information
Structure

Compound Identification

SMILES

C[C@H](N1C[C@@H](CC1=O)C(=O)NC1=NC2=C(S1)C=C(Cl)C=C2)C1=CC=CC=C1

InChIKey

InChIKey=NEJFEMABNHRALW-GXTWGEPZSA-N

Formula

C20H18ClN3O2S

Mass

399.89

Export to:

JSON SDF CSV

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

1,3-benzothiazole - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-3-carboxamide - N-arylamide - Monocyclic benzene moiety - Aryl chloride - Pyrrolidone - 2-pyrrolidone - Aryl halide - N-alkylpyrrolidine - Benzenoid - Tertiary carboxylic acid amide - Thiazole - Azole - Pyrrolidine - Heteroaromatic compound - Secondary carboxylic acid amide - Lactam - Carboxamide group - Carboxylic acid derivative - Azacycle - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - 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

Previous Back Next