Structure Information
Structure

Compound Identification

SMILES

CCC(C)(C)C1=CC(=C(OCCCC(=O)NC2=CC(NC(=O)C(OC3=C(CSC4=NN=NN4C4=CC=CC=C4)C=C(C=C3)[N+]([O-])=O)C(=O)C(C)(C)C)=C(Cl)C=C2)C=C1)C(C)(C)CC

InChIKey

InChIKey=NFRSHBSRJAEGTH-UHFFFAOYSA-N

Formula

C47H56ClN7O7S

Mass

898.52

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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 - Nitrophenyl ether - Phenylpropane - Nitrobenzene - Anilide - N-arylamide - Phenoxy compound - Phenol ether - Aryl thioether - Nitroaromatic compound - Halobenzene - Alkylarylthioether - Alkyl aryl ether - Chlorobenzene - Fatty amide - Benzenoid - Fatty acyl - Monosaccharide - 1,3-dicarbonyl compound - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Heteroaromatic compound - Carboxamide group - Organic nitro compound - Ketone - C-nitro compound - Secondary carboxylic acid amide - Thioether - Sulfenyl compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Organic oxoazanium - Azacycle - Propargyl-type 1,3-dipolar organic compound - Ether - Organic 1,3-dipolar compound - Organosulfur compound - Organic oxygen compound - Organic salt - Organic oxide - Organohalogen compound - Organochloride - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organic zwitterion - Organooxygen compound - Hydrocarbon derivative - 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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