Structure Information
Structure

Compound Identification

SMILES

C[C@@H](SC1=NN=C(CNC2=C(C)C=C(Cl)C=C2)N1C1=CC=CC=C1)C(=O)NNC=C1C(=O)C=CC2=CC=CC=C12

InChIKey

InChIKey=NUWXIBLJEKJSQR-HXUWFJFHSA-N

Formula

C30H27ClN6O2S

Mass

571.1

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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 heteropolycyclic compounds

Substituents

Phenyl-1,2,4-triazole - Naphthalene - Aryl thioether - Aniline or substituted anilines - Phenylalkylamine - Aminotoluene - Chlorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Toluene - Alkylarylthioether - Aralkylamine - Aryl chloride - Benzenoid - Aryl halide - Monocyclic benzene moiety - Vinylogous amide - Heteroaromatic compound - Cyclic ketone - Amino acid or derivatives - Carboxylic acid hydrazide - Ketone - Sulfenyl compound - Azacycle - Thioether - Secondary amine - Carboxylic acid derivative - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Amine - Aldehyde - Organochloride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organosulfur compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - 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

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