Structure Information
Structure

Compound Identification

SMILES

COC1=CC(=CC(OC)=C1OC)C1CC(NN1C(N)=S)=C1C(=O)C(CN2CCOCC2)=C2OC=CC2=C1OC

InChIKey

InChIKey=YKXUVTDAHWIETI-UHFFFAOYSA-N

Formula

C27H32N4O7S

Mass

556.63

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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 - Cyclic ketones - Quinomethanes

Direct Parent

O-quinomethanes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phenoxy compound - Anisole - O-quinomethane - Methoxybenzene - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Morpholine - Oxazinane - Benzenoid - Furan - Heteroaromatic compound - Pyrazolidine - Thiosemicarbazide - Vinylogous amide - Tertiary amine - Tertiary aliphatic amine - Organoheterocyclic compound - Azacycle - Oxacycle - Ether - Dialkyl ether - Organosulfur compound - Organonitrogen compound - Amine - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as o-quinomethanes. These are organic compounds containing a benzene ring conjugated to a methylidene group and a ketone at carbon atoms 1 and 2, respectively.

External Descriptors

Not available

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