Structure Information
Structure

Compound Identification

SMILES

CC(C)OC(=O)C1=C(C)N=C2SC(=CC3=C(C=CC(=C3)[N+]([O-])=O)N3CCN(C)CC3)C(=O)N2C1C1=CC=CC=C1Cl

InChIKey

InChIKey=VPQVBGGFSPSATJ-UHFFFAOYSA-N

Formula

C29H30ClN5O5S

Mass

596.1

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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 Nitrobenzenes Aniline and substituted anilines Dialkylarylamines Nitroaromatic compounds Chlorobenzenes N-methylpiperazines Aryl chlorides Thiazoles Enoate esters Heteroaromatic compounds Trialkylamines Amino acids and derivatives Lactams Isothioureas Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Monocarboxylic acids and derivatives Organic salts Carbonyl compounds Organic zwitterions Organic oxides Organochlorides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

N-arylpiperazine - Phenylpiperazine - Nitrobenzene - Nitroaromatic compound - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - Dialkylarylamine - N-alkylpiperazine - N-methylpiperazine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Benzenoid - Monocyclic benzene moiety - Alpha,beta-unsaturated carboxylic ester - Azole - Thiazole - Enoate ester - Heteroaromatic compound - Amino acid or derivatives - Carboxylic acid ester - Organic nitro compound - Isothiourea - Lactam - C-nitro compound - Tertiary amine - Tertiary aliphatic amine - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Azacycle - Monocarboxylic acid or derivatives - Organic oxoazanium - Organic nitrogen compound - Carbonyl group - Amine - Hydrocarbon derivative - Organonitrogen compound - Organic oxygen compound - Organic zwitterion - Organic oxide - Organic salt - Organohalogen compound - Organooxygen compound - Organochloride - Aromatic heteropolycyclic 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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