Structure Information
Structure

Compound Identification

SMILES

O=S1(=O)CC[C@H](C1)N1CC[NH+](CN2N=C(N(C2=S)C2=CC=CC=C2)C2=CC=CS2)CC1

InChIKey

InChIKey=HVKYOHYGXMBQJF-GOSISDBHSA-O

Formula

C21H26N5O2S3

Mass

476.65

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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 heteromonocyclic compounds

Substituents

Phenyl-1,2,4-triazole - N-alkylpiperazine - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Benzenoid - Quaternary ammonium salt - Sulfone - Thiolane - Thiophene - Heteroaromatic compound - Tertiary amine - Tertiary aliphatic amine - Azacycle - Organic oxygen compound - Organic nitrogen compound - Amine - Organic oxide - Organosulfur compound - Hydrocarbon derivative - Organonitrogen compound - Organic cation - Aromatic heteromonocyclic 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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