Compound Identification
SMILES
CCOC(=O)C1=C(C)N=C2S\C(=C\C3=C(C=CC(=C3)[N+]([O-])=O)N3CC[NH+](C)CC3)C(=O)N2[C@@H]1C1=CC=CC=C1
InChIKey
InChIKey=BUVZEDMCHLBEAV-LBKCIFGTSA-O
Formula
C28H30N5O5S
Mass
548.64
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
-
Class
Diazinanes
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Subclass
Piperazines
- Level 5 Phenylpiperazines
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Subclass
Piperazines
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Class
Diazinanes
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Superclass
Organoheterocyclic compounds
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 N-methylpiperazines Thiazoles Enoate esters Heteroaromatic compounds Quaternary ammonium salts Lactams Isothioureas Trialkylamines Amino acids and derivatives Monocarboxylic acids and derivatives Azacyclic compounds Organic oxoazanium compounds Carbonyl compounds Hydrocarbon derivatives Organic salts Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylpiperazine - N-arylpiperazine - Nitrobenzene - Nitroaromatic compound - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - Dialkylarylamine - N-methylpiperazine - N-alkylpiperazine - Monocyclic benzene moiety - Benzenoid - Azole - Quaternary ammonium salt - Thiazole - Heteroaromatic compound - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Organic nitro compound - Tertiary aliphatic amine - Carboxylic acid ester - Tertiary amine - Isothiourea - Amino acid or derivatives - Lactam - C-nitro compound - Azacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxoazanium - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organic salt - Amine - Organooxygen compound - Organic oxygen compound - Organonitrogen compound - Organic cation - 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