Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC(OC(=O)NC2=CC3=C(SC(C)=C3CCN(C)CC3=NN=CC(=C3)N(C)C)C=C2)=C1

InChIKey

InChIKey=HTZNCCDPRLJAIN-UHFFFAOYSA-N

Formula

C27H31N5O3S

Mass

505.64

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzothiophenes

Subclass

1-benzothiophenes

Intermediate Tree Nodes

Not available

Direct Parent

1-benzothiophenes

Alternative Parents

Phenoxy compounds Methoxybenzenes Dialkylarylamines Anisoles Aralkylamines Aminopyridazines Alkyl aryl ethers Thiophenes Heteroaromatic compounds Carbamate esters Trialkylamines Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-benzothiophene - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Methoxybenzene - Phenol ether - Anisole - Phenoxy compound - Aralkylamine - Alkyl aryl ether - Aminopyridazine - Pyridazine - Benzenoid - Monocyclic benzene moiety - Thiophene - Heteroaromatic compound - Carbamic acid ester - Tertiary amine - Tertiary aliphatic amine - Ether - Azacycle - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1-benzothiophenes. These are aromatic heterocyclic compound containing the Benzo[b]thiophene ring system.

External Descriptors

Not available

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