Structure Information
Structure

Compound Identification

SMILES

CC1=NN(C2=C1C=C(S2)C(=O)OCCNC(=O)C1=CC2=C(C=C1)C(=O)C1=CC=CC=C1S2(=O)=O)C1=CC=CC=C1Cl

InChIKey

InChIKey=PWDQLJSZAHBLAA-UHFFFAOYSA-N

Formula

C29H20ClN3O6S2

Mass

606.06

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzothiopyrans

Subclass

1-benzothiopyrans

Intermediate Tree Nodes

Thioxanthenes

Direct Parent

Thioxanthones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Thioxanthone - Phenylpyrazole - Thiophene carboxylic acid or derivatives - 2,3,5-trisubstituted thiophene - Aryl ketone - Halobenzene - Chlorobenzene - Aryl halide - Benzenoid - Aryl chloride - Monocyclic benzene moiety - Heteroaromatic compound - Thiophene - Azole - Sulfone - Pyrazole - Ketone - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Organic oxide - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as thioxanthones. These are compounds containing a thioxanthene moiety which bears an ketone group.

External Descriptors

Not available

Previous Back Next