Structure Information
Structure

Compound Identification

SMILES

C[C@@H](OC(=O)CC1=NN(CC2=NC3=C(S2)C=CC(=C3)C(F)(F)F)C(=O)C2=CC=CC=C12)C1=NC=CC(=N1)N1CCN(CC1)C(=O)\C=C\C1=CC=CS1

InChIKey

InChIKey=XRLBUCIQWUBDOD-XBFAEUMISA-N

Formula

C36H30F3N7O4S2

Mass

745.8

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazinanes

Subclass

Piperazines

Intermediate Tree Nodes

Not available

Direct Parent

N-arylpiperazines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

N-arylpiperazine - Phthalazinone - Phthalazine - 1,3-benzothiazole - Dialkylarylamine - Pyridazinone - Aminopyrimidine - Pyridazine - Pyrimidine - Benzenoid - Imidolactam - Thiazole - Tertiary carboxylic acid amide - Heteroaromatic compound - Azole - Thiophene - Tertiary amine - Lactam - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Monocarboxylic acid or derivatives - Azacycle - Carboxylic acid derivative - Organic oxide - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Alkyl fluoride - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Amine - Alkyl halide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as n-arylpiperazines. These are organic compounds containing a piperazine ring where the nitrogen ring atom carries an aryl group.

External Descriptors

Not available

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