Structure Information
Structure

Compound Identification

SMILES

COC1=C(C2C[C@H]2NC(=S)NC2=NC=C(C=C2)C#N)C(O)=C(C=C1)C(C)=O

InChIKey

InChIKey=FSRLCMRWYUJTNT-ARLHGKGLSA-N

Formula

C19H18N4O3S

Mass

382.44

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Aryl ketones - Phenylketones

Direct Parent

Alkyl-phenylketones

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Alkyl-phenylketone - Methoxyphenol - Acetophenone - Aryl alkyl ketone - Phenol ether - 3-pyridinecarbonitrile - Methoxybenzene - Phenoxy compound - Benzoyl - Anisole - Phenol - 1-hydroxy-4-unsubstituted benzenoid - Alkyl aryl ether - Imidolactam - Benzenoid - Monocyclic benzene moiety - Pyridine - Heteroaromatic compound - Vinylogous acid - Thiourea - Organoheterocyclic compound - Nitrile - Carbonitrile - Azacycle - Ether - Organosulfur compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Cyanide - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.

External Descriptors

Not available

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