Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CC=CC(=C1)C(\SC1=NN=NN1C1=CC(Cl)=CC=C1)=C/C#N

InChIKey

InChIKey=SMYIRHZXPCXHBQ-VIZOYTHASA-N

Formula

C16H9ClN6O2S

Mass

384.8

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Tetrazoles

Intermediate Tree Nodes

Not available

Direct Parent

Phenyltetrazoles and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenyltetrazole - Nitrobenzene - Aryl thioether - Nitroaromatic compound - Styrene - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Thioenolether - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carbonitrile - Nitrile - Azacycle - Organic oxoazanium - Organic oxygen compound - Organic salt - Organochloride - Organohalogen compound - Organonitrogen compound - Organosulfur compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Cyanide - Organic cation - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenyltetrazoles and derivatives. These are compounds containing a phenyltetrazole skeleton, which consists of a tetrazole bound to a phenyl group.

External Descriptors

Not available

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