Structure Information
Structure

Compound Identification

SMILES

ClC1=C(C=CC=N1)C(=O)N1CCCN1C(=S)NCC1=CC2=C(OCO2)C=C1

InChIKey

InChIKey=ZMUKWMQFJPOBLQ-UHFFFAOYSA-N

Formula

C18H17ClN4O3S

Mass

404.87

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzodioxoles

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzodioxoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzodioxole - Pyridine carboxylic acid or derivatives - 2-halopyridine - Aryl chloride - Aryl halide - Pyridine - Benzenoid - Pyrazolidine - Heteroaromatic compound - Thiosemicarbazide - Vinylogous halide - Carboxylic acid hydrazide - Oxacycle - Acetal - Carboxylic acid derivative - Azacycle - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzodioxoles. These are organic compounds containing a benzene ring fused to either isomers of dioxole. Dioxole is a five-membered unsaturated ring of two oxygen atoms and three carbon atoms.

External Descriptors

Not available

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