Structure Information
Structure

Compound Identification

SMILES

CC1=CC2=C(C=C1)N=C(S2)C1=CC=C(C=C1)N1C(=O)C[C@H](N2CCN(CC2)C2=CC=C(C=C2)[N+]([O-])=O)C1=O

InChIKey

InChIKey=OCPPKYLAFICUSP-DEOSSOPVSA-N

Formula

C28H25N5O4S

Mass

527.6

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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 Phenylpyrrolidines Alpha amino acids and derivatives Benzothiazoles Nitrobenzenes Aniline and substituted anilines Dialkylarylamines Nitroaromatic compounds N-alkylpiperazines Pyrrolidine-2-ones N-substituted carboxylic acid imides Thiazoles Pyrroles Dicarboximides Heteroaromatic compounds Lactams Trialkylamines Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Hydrocarbon derivatives Carbonyl compounds Organic zwitterions Organic salts Organic oxides

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

N-arylpiperazine - Phenylpiperazine - 1-phenylpyrrolidine - Alpha-amino acid or derivatives - 1,3-benzothiazole - Nitrobenzene - Nitroaromatic compound - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - Dialkylarylamine - N-alkylpiperazine - Benzenoid - Monocyclic benzene moiety - 2-pyrrolidone - Pyrrolidone - Carboxylic acid imide, n-substituted - Dicarboximide - Carboxylic acid imide - Heteroaromatic compound - Pyrrole - Pyrrolidine - Thiazole - Azole - Amino acid or derivatives - Organic nitro compound - Lactam - C-nitro compound - Tertiary aliphatic amine - Tertiary amine - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Azacycle - Organic 1,3-dipolar compound - Organic oxoazanium - Amine - Organic oxide - Organic zwitterion - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organic salt - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - 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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