Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=C(CSC2=NC(CC)=C(C)C=C2C#N)OC(N)=C(C#N)C1C1=CC=CC=C1Cl

InChIKey

InChIKey=ASZIITNXZBXTMZ-UHFFFAOYSA-N

Formula

C25H23ClN4O3S

Mass

494.99

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organosulfur compounds

Class

Thioethers

Subclass

Aryl thioethers

Intermediate Tree Nodes

Not available

Direct Parent

Aryl thioethers

Alternative Parents

3-pyridinecarbonitriles Alkylarylthioethers Chlorobenzenes Methylpyridines Aryl chlorides Pyrans Heteroaromatic compounds Enoate esters Vinylogous esters Ketene acetals Nitriles Monocarboxylic acids and derivatives Azacyclic compounds Oxacyclic compounds Sulfenyl compounds Organopnictogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Aryl thioether - 3-pyridinecarbonitrile - Chlorobenzene - Methylpyridine - Halobenzene - Alkylarylthioether - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyridine - Pyran - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous ester - Heteroaromatic compound - Carboxylic acid ester - Ketene acetal or derivatives - Carboxylic acid derivative - Oxacycle - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Cyanide - Organic oxide - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as aryl thioethers. These are organosulfur compounds containing a thioether group that is substituted by an aryl group.

External Descriptors

Not available

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