Compound Identification
SMILES
OC(=O)C(F)(F)F.FC(F)(F)C1=CC2=C(N=C(N2)N2CCN(CC2)C2=C(C=CC=N2)C(F)(F)F)C(=C1)C1=NC=CS1
InChIKey
InChIKey=VMCWOARWQVYPAD-UHFFFAOYSA-N
Formula
C23H17F9N6O2S
Mass
612.47
Taxonomic Classification
Taxonomy Tree
-
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 Benzimidazoles Dialkylarylamines Aminopyridines and derivatives Aminoimidazoles Imidolactams Benzenoids Thiazoles Alpha-halocarboxylic acids Heteroaromatic compounds Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Organofluorides Alkyl fluorides Hydrocarbon derivatives Organic oxides Carbonyl compounds
Molecular Framework
Not available
Substituents
Pyridinylpiperazine - N-arylpiperazine - Benzimidazole - Dialkylarylamine - Aminopyridine - Aminoimidazole - Pyridine - Imidolactam - Benzenoid - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Azole - Imidazole - Heteroaromatic compound - Thiazole - Azacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carboxylic acid - Organofluoride - Alkyl halide - Organohalogen compound - Carbonyl group - Organic oxide - Alkyl fluoride - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Amine - Organic nitrogen compound - Aromatic heteropolycyclic 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