Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(\C=N/C(/N)=N/C2=NC3=C(S2)C(=O)N(N3)C2=C(C=C(C=C2)[N+]([O-])=O)[N+]([O-])=O)C=C1

InChIKey

InChIKey=ANLKASWCXLHIBL-NKVSQWTQSA-N

Formula

C19H14N8O6S

Mass

482.43

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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

Nitrobenzenes Phenoxy compounds Anisoles Nitroaromatic compounds Methoxybenzenes Alkyl aryl ethers Pyrazolones Vinylogous amides Thiazoles Heteroaromatic compounds Shiff bases Lactams Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phenylpyrazole - Nitrobenzene - Phenoxy compound - Nitroaromatic compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Benzenoid - Pyrazolinone - Monocyclic benzene moiety - Heteroaromatic compound - Thiazole - Vinylogous amide - Lactam - Shiff base - C-nitro compound - Organic nitro compound - Ether - Azacycle - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic salt - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Organic zwitterion - 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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