Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(C=C1)C1=CN=C(S1)N1NC(C)=C([C@H]([C@H](C#N)C(N)=O)C2=CC=CC=C2)C1=O

InChIKey

InChIKey=URQPSKXKAMFZHF-RXVVDRJESA-N

Formula

C24H21N5O3S

Mass

459.52

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Phenol ethers

Subclass

Anisoles

Intermediate Tree Nodes

Not available

Direct Parent

Anisoles

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenoxy compound - Anisole - Methoxybenzene - 2,5-disubstituted 1,3-thiazole - Alkyl aryl ether - Pyrazolinone - Monocyclic benzene moiety - Fatty amide - Fatty acyl - Pyrazole - Azole - Thiazole - Heteroaromatic compound - Vinylogous amide - Primary carboxylic acid amide - Lactam - Carboxamide group - Azacycle - Carboxylic acid derivative - Ether - Organoheterocyclic compound - Carbonitrile - Nitrile - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Cyanide - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as anisoles. These are organic compounds containing a methoxybenzene or a derivative thereof.

External Descriptors

Not available

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