Compound Identification
SMILES
OC1=CC=CC(=C1)N1CCN(CC2=NC3=C(C4=CC=CC=C4S3)C(=O)N2)CC1
InChIKey
InChIKey=VWKHQYPDQAJEPO-UHFFFAOYSA-N
Formula
C21H20N4O2S
Mass
392.48
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 1-benzothiophenes Thienopyrimidines m-Aminophenols Aniline and substituted anilines Dialkylarylamines Pyrimidones 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids N-alkylpiperazines Aralkylamines Thiophenes Heteroaromatic compounds Trialkylamines Lactams Azacyclic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-arylpiperazine - Phenylpiperazine - Thienopyrimidine - 1-benzothiophene - Benzothiophene - Tertiary aliphatic/aromatic amine - M-aminophenol - Aniline or substituted anilines - Dialkylarylamine - Aminophenol - Pyrimidone - Phenol - Aralkylamine - N-alkylpiperazine - 1-hydroxy-2-unsubstituted benzenoid - 1-hydroxy-4-unsubstituted benzenoid - Pyrimidine - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Thiophene - Tertiary aliphatic amine - Lactam - Tertiary amine - Azacycle - Amine - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen 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