Compound Identification
SMILES
[O-][N+](=O)C1=CC=C(C=C1)N1CCN(CC1)S(=O)(=O)C1=CC2=C(CCN(C2)C(=O)C(F)(F)F)C=C1
InChIKey
InChIKey=OSBRUDYBANIGDT-UHFFFAOYSA-N
Formula
C21H21F3N4O5S
Mass
498.48
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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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 Tetrahydroisoquinolines Nitrobenzenes Aniline and substituted anilines Dialkylarylamines Nitroaromatic compounds Organosulfonamides Sulfonyls Tertiary carboxylic acid amides Amino acids and derivatives Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxides Organofluorides Alkyl fluorides Hydrocarbon derivatives Carbonyl compounds Organic salts Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylpiperazine - N-arylpiperazine - Tetrahydroisoquinoline - Nitrobenzene - Nitroaromatic compound - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - Dialkylarylamine - Monocyclic benzene moiety - Organosulfonic acid amide - Benzenoid - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Tertiary carboxylic acid amide - Organic nitro compound - Amino acid or derivatives - Tertiary amine - Carboxamide group - C-nitro compound - Propargyl-type 1,3-dipolar organic compound - Azacycle - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Organic oxoazanium - Organic salt - Amine - Organooxygen compound - Organonitrogen compound - Organofluoride - Organosulfur compound - Organohalogen compound - Organic oxygen compound - Organic oxide - Alkyl fluoride - Alkyl halide - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - 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