Structure Information
Structure

Compound Identification

SMILES

C[C@@H](OC1=CC=C(F)C=C1)C1=NN=C(O1)S[C@@H](C)C(=O)C1=CNC2=CC=CC=C12

InChIKey

InChIKey=BCWURSPPWIUTEK-OLZOCXBDSA-N

Formula

C21H18FN3O3S

Mass

411.45

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Indoles and derivatives

Subclass

Indoles

Intermediate Tree Nodes

Not available

Direct Parent

Indoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Indole - Phenoxy compound - Aryl thioether - Phenol ether - Aryl ketone - Aryl alkyl ketone - Alkyl aryl ether - Fluorobenzene - Halobenzene - Alkylarylthioether - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Substituted pyrrole - Benzenoid - Vinylogous amide - Heteroaromatic compound - Azole - 1,3,4-oxadiazole - Oxadiazole - Pyrrole - Ketone - Sulfenyl compound - Thioether - Azacycle - Oxacycle - Ether - Organosulfur compound - Organic nitrogen compound - Organopnictogen compound - Aldehyde - Organohalogen compound - Organofluoride - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as indoles. These are compounds containing an indole moiety, which consists of pyrrole ring fused to benzene to form 2,3-benzopyrrole.

External Descriptors

Not available

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