Structure Information
Structure

Compound Identification

SMILES

CC1=CC=CC(=C1)C1=NN2C(SC3C(N(N=C23)C2=C(C=C(C=C2)[N+]([O-])=O)[N+]([O-])=O)C2=CC=C(Cl)C=C2)=N1

InChIKey

InChIKey=ANYRDXQDUFEVAM-UHFFFAOYSA-N

Formula

C24H16ClN7O4S

Mass

533.95

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Triazoles

Intermediate Tree Nodes

Phenyltriazoles

Direct Parent

Phenyl-1,2,4-triazoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phenyl-1,2,4-triazole - Nitrobenzene - Aryl thioether - Nitroaromatic compound - Chlorobenzene - Halobenzene - Toluene - Alkylarylthioether - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Imidolactam - Heteroaromatic compound - Pyrazoline - Organic nitro compound - Carboxylic acid amidrazone - C-nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Thioether - Organic 1,3-dipolar compound - Hydrazone - Organic oxoazanium - Organic zwitterion - Organic oxide - Organohalogen compound - Organochloride - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Hydrocarbon derivative - Organic salt - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenyl-1,2,4-triazoles. These are organic compounds containing a 1,2,4-triazole substituted by a phenyl group.

External Descriptors

Not available

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