Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=C(C)N=C2SC(=CC3=CN(N=C3C3=CC(Br)=C(OC)C=C3)C3=CC=CC=C3)C(=O)N2C1C1=CC=C(SC)C=C1

InChIKey

InChIKey=MLCJRFYYOXAMPK-UHFFFAOYSA-N

Formula

C33H27BrN4O4S2

Mass

687.63

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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

Phenylpyrazole - Anisole - Phenoxy compound - Aryl thioether - Phenol ether - Thiophenol ether - Methoxybenzene - Alkyl aryl ether - Bromobenzene - Halobenzene - Alkylarylthioether - Monocyclic benzene moiety - Aryl halide - Benzenoid - Aryl bromide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Thiazole - Heteroaromatic compound - Isothiourea - Lactam - Carboxylic acid ester - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Sulfenyl compound - Azacycle - Thioether - Hydrocarbon derivative - Organohalogen compound - Organobromide - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Organic oxide - 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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