Structure Information
Structure

Compound Identification

SMILES

COC1=CC(CCN2CCN(CC(O)COC3=CC=C(C=C3)C3=NN(C)C4=C3SC=C4)CC2)=CC(OC)=C1OC

InChIKey

InChIKey=WBXJOGCUPUJAGZ-UHFFFAOYSA-N

Formula

C30H38N4O5S

Mass

566.72

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Pyrazoles

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpyrazoles

Alternative Parents

Phenethylamines Phenoxy compounds Methoxybenzenes Anisoles N-alkylpiperazines Aralkylamines Alkyl aryl ethers Thiophenes Heteroaromatic compounds Trialkylamines Secondary alcohols 1,2-aminoalcohols Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phenylpyrazole - Phenethylamine - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - N-alkylpiperazine - Aralkylamine - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Benzenoid - Heteroaromatic compound - Thiophene - Tertiary amine - Secondary alcohol - Tertiary aliphatic amine - 1,2-aminoalcohol - Azacycle - Ether - Amine - Organonitrogen compound - Alcohol - Organooxygen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpyrazoles. These are compounds containing a phenylpyrazole skeleton, which consists of a pyrazole bound to a phenyl group.

External Descriptors

Not available

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