Structure Information
Structure

Compound Identification

SMILES

C[NH+](C)CCCN1C(C(C(=O)C2=C(C)N=C(C)S2)=C([O-])C1=O)C1=CC=CC=C1F

InChIKey

InChIKey=FOFWMAANUMCOKY-UHFFFAOYSA-N

Formula

C21H24FN3O3S

Mass

417.5

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyrrolines

Subclass

Phenylpyrrolines

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpyrrolines

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

2-phenylpyrroline - 2,4,5-trisubstituted 1,3-thiazole - Pyrroline carboxylic acid or derivatives - Aryl ketone - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Vinylogous acid - Azole - Thiazole - Tertiary carboxylic acid amide - Pyrrole - Quaternary ammonium salt - Heteroaromatic compound - Tertiary aliphatic amine - Amino acid or derivatives - Carboxamide group - Ketone - Lactam - Tertiary amine - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Carbonyl group - Organic salt - Organic zwitterion - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Amine - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpyrrolines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrroline ring through a CC or CN bond.

External Descriptors

Not available

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