Compound Identification
SMILES
OC(=O)C(F)(F)F.NCC1(CC[C@]2(ON12)C1=NC=NC2=C1SCC2)N1CCN(CC1)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=TVLBOYBCFZKRAX-OXBIGKRVSA-N
Formula
C23H26ClF3N6O3S
Mass
559.01
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 Thienopyrimidines Dialkylarylamines Aniline and substituted anilines Chlorobenzenes Aralkylamines N-alkylpiperazines Alkylarylthioethers Pyrimidines and pyrimidine derivatives Aryl chlorides 1,2-oxazinanes Heteroaromatic compounds Pyrrolidines Alpha-halocarboxylic acids Oxacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives N-organohydroxylamines Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Monoalkylamines Organic oxides Organochlorides Alkyl fluorides Organofluorides
Molecular Framework
Not available
Substituents
Phenylpiperazine - N-arylpiperazine - Thienopyrimidine - Aryl thioether - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Chlorobenzene - Halobenzene - N-alkylpiperazine - Alkylarylthioether - Aralkylamine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - 1,2-oxazinane - Oxazinane - Pyrimidine - Benzenoid - Alpha-halocarboxylic acid - Pyrrolidine - Alpha-halocarboxylic acid or derivatives - Heteroaromatic compound - Tertiary amine - Thioether - Azacycle - N-organohydroxylamine - Oxacycle - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxygen compound - Primary aliphatic amine - Alkyl fluoride - Organohalogen compound - Organochloride - Organofluoride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Primary amine - Organic oxide - Amine - Alkyl halide - Hydrocarbon derivative - 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