Compound Identification
SMILES
CC1(C)CCC(CN2CCN(CC2)C2=CC(OC3=CN=C4NC=CC4=C3)=C(C=C2)C(=O)NS(=O)(=O)C2=CC(=C(OCC3(F)CCC(CC3)N(CCC#N)C3CC3)C=C2)[N+]([O-])=O)=C(C1)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=ZWCCJYQZGSTUAL-UHFFFAOYSA-N
Formula
C52H58ClFN8O7S
Mass
993.59
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 Diarylethers Nitrophenyl ethers Aminobenzoic acids and derivatives Benzenesulfonamides Pyrrolopyridines Benzenesulfonyl compounds Aniline and substituted anilines Phenoxy compounds Phenol ethers Benzoyl derivatives Dialkylarylamines Nitroaromatic compounds Alkyl aryl ethers Chlorobenzenes Cyclohexyl halides Cyclohexylamines N-alkylpiperazines Aryl chlorides Pyridines and derivatives Aminosulfonyl compounds Pyrroles Heteroaromatic compounds Organosulfonic acids and derivatives Trialkylamines Amino acids and derivatives Organic oxoazanium compounds Nitriles Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organochlorides Hydrocarbon derivatives Organic zwitterions Organic salts Organofluorides Organic oxides Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-arylpiperazine - Phenylpiperazine - Diaryl ether - Nitrophenyl ether - Benzenesulfonamide - Aminobenzoic acid or derivatives - Benzoic acid or derivatives - Benzenesulfonyl group - Pyrrolopyridine - Nitrobenzene - Tertiary aliphatic/aromatic amine - Benzoyl - Nitroaromatic compound - Phenoxy compound - Aniline or substituted anilines - Dialkylarylamine - Phenol ether - Halobenzene - Cyclohexylamine - Chlorobenzene - Cyclohexyl halide - Alkyl aryl ether - N-alkylpiperazine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyridine - Benzenoid - Heteroaromatic compound - Sulfonyl - Aminosulfonyl compound - Pyrrole - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Organic nitro compound - Amino acid or derivatives - C-nitro compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Ether - Organic oxoazanium - Azacycle - Allyl-type 1,3-dipolar organic compound - Carbonitrile - Nitrile - Organic 1,3-dipolar compound - Amine - Organic salt - Organohalogen compound - Organochloride - Organofluoride - Hydrocarbon derivative - Organic oxide - Cyanide - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organic zwitterion - Organooxygen compound - Organosulfur compound - 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