Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=C(NC(=O)CSC2=NN=C(CNC(=O)C3=CC=CS3)N2C2=CC=C(C=C2)[N+]([O-])=O)SC2=C1CCCC2

InChIKey

InChIKey=UTMCQWHGNKDGGV-UHFFFAOYSA-N

Formula

C27H26N6O6S3

Mass

626.72

Export to:

JSON SDF CSV

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 - 2-heteroaryl carboxamide - Aryl thioether - Nitroaromatic compound - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - N-arylamide - Alkylarylthioether - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Thiophene - Vinylogous amide - Carboxamide group - Carboxylic acid ester - C-nitro compound - Secondary carboxylic acid amide - Organic nitro compound - Carboxylic acid derivative - Sulfenyl compound - Azacycle - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Thioether - Organic 1,3-dipolar compound - Organic oxoazanium - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organosulfur compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organic salt - Organic zwitterion - Organic oxide - 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

Previous Back Next