Structure Information
Structure

Compound Identification

SMILES

CC1=NN(C(=O)\C1=N\NC1=CC=C(C=C1)C1=NNC(=S)N1CC=C)C1=CC=CC=C1

InChIKey

InChIKey=IYTIBRIMMVMZCQ-PTGBLXJZSA-N

Formula

C21H19N7OS

Mass

417.49

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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 - Phenylhydrazine - Monocyclic benzene moiety - Pyrazolinone - Benzenoid - Pyrazoline - Heteroaromatic compound - Carboxylic acid derivative - Hydrazone - Azacycle - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - 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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