Structure Information
Structure

Compound Identification

SMILES

OC1=C(C(N(CC2CCCO2)C1=O)C1=CC=CC=C1Cl)C(=O)C1=CC=CS1

InChIKey

InChIKey=JYCWIIPBAILXSI-UHFFFAOYSA-N

Formula

C20H18ClNO4S

Mass

403.88

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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

Pyrroline carboxylic acids and derivatives Aryl ketones Chlorobenzenes Aryl chlorides Vinylogous acids Thiophenes Tertiary carboxylic acid amides Pyrroles Oxolanes Heteroaromatic compounds Lactams Oxacyclic compounds Azacyclic compounds Dialkyl ethers Enols Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

2-phenylpyrroline - Pyrroline carboxylic acid or derivatives - Aryl ketone - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Oxolane - Pyrrole - Heteroaromatic compound - Vinylogous acid - Thiophene - Tertiary carboxylic acid amide - Carboxamide group - Ketone - Lactam - Carboxylic acid derivative - Oxacycle - Dialkyl ether - Enol - Ether - Azacycle - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organohalogen compound - Organochloride - 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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