Compound Identification
SMILES
CC(C)OC1=C(NC2=NC=C3SC(C(N)=O)=C(C3=N2)C2=CC=C(F)C=C2)C=CC(=C1)N1CCN(C)CC1
InChIKey
InChIKey=KTJIUAQLLBCQRG-UHFFFAOYSA-N
Formula
C27H29FN6O2S
Mass
520.63
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 Aminophenyl ethers Thienopyrimidines Pyrimidinecarboxamides 2-heteroaryl carboxamides Aniline and substituted anilines Dialkylarylamines Thiophene carboxamides Phenoxy compounds Fluorobenzenes Alkyl aryl ethers N-methylpiperazines Aminopyrimidines and derivatives Aryl fluorides Heteroaromatic compounds Trialkylamines Amino acids and derivatives Primary carboxylic acid amides Azacyclic compounds Hydrocarbon derivatives Organic oxides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylpiperazine - N-arylpiperazine - Pyrimidinecarboxamide - Thienopyrimidine - Aminophenyl ether - Phenol ether - 2-heteroaryl carboxamide - Tertiary aliphatic/aromatic amine - Phenoxy compound - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - Dialkylarylamine - Aniline or substituted anilines - N-alkylpiperazine - N-methylpiperazine - Fluorobenzene - Halobenzene - Aminopyrimidine - Alkyl aryl ether - Aryl fluoride - Benzenoid - Aryl halide - Pyrimidine - Monocyclic benzene moiety - Thiophene - Heteroaromatic compound - Amino acid or derivatives - Tertiary amine - Tertiary aliphatic amine - Carboxamide group - Primary carboxylic acid amide - Carboxylic acid derivative - Ether - Azacycle - Organic oxide - Organohalogen compound - Organofluoride - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Amine - Organic nitrogen compound - 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