Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC)C=C(C(=C1)C(=O)NC1=C2CSCC2=NN1C1=CC=C(Cl)C=C1)[N+]([O-])=O

InChIKey

InChIKey=DBQWDRWVFDAFDL-UHFFFAOYSA-N

Formula

C20H17ClN4O5S

Mass

460.89

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Pyrazoles

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpyrazoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Nitrophenyl ether - Phenylpyrazole - O-dimethoxybenzene - Dimethoxybenzene - Benzamide - Benzoic acid or derivatives - Nitrobenzene - Methoxyaniline - Anisole - Phenoxy compound - Nitroaromatic compound - Benzoyl - Phenol ether - Methoxybenzene - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - Organic nitro compound - C-nitro compound - Dialkylthioether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Thioether - Carboxylic acid derivative - Ether - Azacycle - Organic oxoazanium - Organic oxygen compound - Organic salt - Organic nitrogen compound - Organic zwitterion - Organic oxide - Organooxygen compound - Organohalogen compound - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpyrazoles. These are compounds containing a phenylpyrazole skeleton, which consists of a pyrazole bound to a phenyl group.

External Descriptors

Not available

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