Compound Identification
SMILES
C[C@@H](OC(=O)CC1=NN(CC2=NC3=C(S2)C=CC(=C3)C(F)(F)F)C(=O)C2=CC=CC=C12)C1=NC=CC(=N1)N1CCN(CC1)C(=O)\C=C\C1=CC=CS1
InChIKey
InChIKey=XRLBUCIQWUBDOD-XBFAEUMISA-N
Formula
C36H30F3N7O4S2
Mass
745.8
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 N-arylpiperazines
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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
N-arylpiperazines
Alternative Parents
Phthalazinones Benzothiazoles Dialkylarylamines Pyridazinones Aminopyrimidines and derivatives Imidolactams Benzenoids Thiophenes Thiazoles Tertiary carboxylic acid amides Heteroaromatic compounds Amino acids and derivatives Lactams Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-arylpiperazine - Phthalazinone - Phthalazine - 1,3-benzothiazole - Dialkylarylamine - Pyridazinone - Aminopyrimidine - Pyridazine - Pyrimidine - Benzenoid - Imidolactam - Thiazole - Tertiary carboxylic acid amide - Heteroaromatic compound - Azole - Thiophene - Tertiary amine - Lactam - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Monocarboxylic acid or derivatives - Azacycle - Carboxylic acid derivative - Organic oxide - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Alkyl fluoride - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Amine - Alkyl halide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-arylpiperazines. These are organic compounds containing a piperazine ring where the nitrogen ring atom carries an aryl group.
External Descriptors
Not available