Compound Identification
SMILES
COC1=CC=C(\C=C\C(=O)N2CCN(CC2)C2=C(F)C=C(C=C2)N2C[C@H](CNC(C)=S)OC2=O)C=C1
InChIKey
InChIKey=NAFUMLQFFBWQMI-FNNZQJQASA-N
Formula
C26H29FN4O4S
Mass
512.6
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
Cinnamic acids and derivatives N-arylpiperazines Aniline and substituted anilines Anisoles Styrenes Phenoxy compounds Dialkylarylamines Methoxybenzenes Alkyl aryl ethers Fluorobenzenes Aryl fluorides Oxazolidinones Tertiary carboxylic acid amides Carbamate esters Thioamides Oxacyclic compounds Azacyclic compounds Thiocarboxylic acid amides Hydrocarbon derivatives Thiocarbonyl compounds Carbonyl compounds Organofluorides Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid or derivatives - Phenylpiperazine - N-arylpiperazine - Anisole - Phenol ether - Phenoxy compound - Styrene - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Methoxybenzene - Fluorobenzene - Halobenzene - Alkyl aryl ether - Benzenoid - Aryl fluoride - Oxazolidinone - Aryl halide - Monocyclic benzene moiety - Carbamic acid ester - Oxazolidine - Thioamide - Tertiary carboxylic acid amide - Carboxamide group - Amino acid or derivatives - Tertiary amine - Oxacycle - Azacycle - Thiocarboxylic acid amide - Ether - Carboxylic acid derivative - Organic oxide - Organohalogen compound - Organic nitrogen compound - Organofluoride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organosulfur compound - Amine - Thiocarbonyl group - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteromonocyclic 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