Compound Identification
SMILES
O[C@H](CSC1=CC=CC=C1)C[NH+]1CCN(CC1)C1=[NH+]C=C(C=C1)C(F)(F)F
InChIKey
InChIKey=AUFBUFJSMWPMLU-INIZCTEOSA-P
Formula
C19H24F3N3OS
Mass
399.48
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 Pyridinylpiperazines
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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
Pyridinylpiperazines
Alternative Parents
N-arylpiperazines Thiophenol ethers Dialkylarylamines Alkylarylthioethers Aminopyridines and derivatives N-alkylpiperazines Benzene and substituted derivatives Pyridinium derivatives Quaternary ammonium salts Heteroaromatic compounds Secondary alcohols 1,2-aminoalcohols Trialkylamines Azacyclic compounds Sulfenyl compounds Alkyl fluorides Hydrocarbon derivatives Organofluorides Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyridinylpiperazine - N-arylpiperazine - Thiophenol ether - Aryl thioether - Dialkylarylamine - Aminopyridine - N-alkylpiperazine - Alkylarylthioether - Monocyclic benzene moiety - Pyridinium - Pyridine - Benzenoid - Heteroaromatic compound - Quaternary ammonium salt - Secondary alcohol - 1,2-aminoalcohol - Tertiary amine - Tertiary aliphatic amine - Thioether - Sulfenyl compound - Azacycle - Organic nitrogen compound - Alcohol - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Organic oxygen compound - Amine - Alkyl halide - Alkyl fluoride - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyridinylpiperazines. These are compounds containing a pyridinylpiperazine skeleton, which consists of a pyridine linked (not fused) to a piperazine by a bond by a single bond that is not part of a ring.
External Descriptors
Not available