Structure Information
Structure

Compound Identification

SMILES

COC1=CC(Cl)=C(OC)C=C1NC(=S)N1CCN(CC1)C1=CC=CC=C1C#N

InChIKey

InChIKey=YHTJEQUBRQCOQS-UHFFFAOYSA-N

Formula

C20H21ClN4O2S

Mass

416.92

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazinanes

Subclass

Piperazines

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpiperazines

Alternative Parents

N-arylpiperazines N-phenylthioureas Dimethoxybenzenes Methoxyanilines Phenoxy compounds Anisoles Dialkylarylamines Benzonitriles Alkyl aryl ethers Chlorobenzenes Aryl chlorides Thioureas Nitriles Azacyclic compounds Hydrocarbon derivatives Organochlorides

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenylpiperazine - N-arylpiperazine - N-phenylthiourea - Dimethoxybenzene - P-dimethoxybenzene - Methoxyaniline - Anisole - Benzonitrile - Phenol ether - Phenoxy compound - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Methoxybenzene - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Monocyclic benzene moiety - Aryl halide - Benzenoid - Thiourea - Tertiary amine - Azacycle - Ether - Carbonitrile - Nitrile - Organochloride - Amine - Organonitrogen compound - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Hydrocarbon derivative - Cyanide - Organohalogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpiperazines. These are compounds containing a phenylpiperazine skeleton, which consists of a piperazine bound to a phenyl group.

External Descriptors

Not available

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