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=C(Br)C=CC1=O

InChIKey

InChIKey=TXZBXSGUMWKMEB-KRWDZBQOSA-N

Formula

C26H24BrClN6O2S

Mass

599.93

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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 - O-quinomethane - Aniline or substituted anilines - Phenylalkylamine - Aminotoluene - Quinomethane - Aryl thioether - Chlorobenzene - Aralkylamine - Toluene - Alkylarylthioether - Secondary aliphatic/aromatic amine - Halobenzene - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Heteroaromatic compound - Vinylogous amide - Ketone - Amino acid or derivatives - Carboxylic acid hydrazide - Cyclic ketone - Carboxylic acid derivative - Azacycle - Bromoalkene - Haloalkene - Sulfenyl compound - Vinyl halide - Vinyl bromide - Secondary amine - Thioether - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organobromide - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organopnictogen compound - Organic oxide - Carbonyl group - Aldehyde - 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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