Compound Identification
SMILES
CN1CCN(CCCN2[C@@H](SCC2=O)C2=CC=C(F)C=C2)CC1
InChIKey
InChIKey=WHUNKNZDNBFZAG-KRWDZBQOSA-N
Formula
C17H24FN3OS
Mass
337.46
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Halobenzenes
- Level 5 Fluorobenzenes
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Subclass
Halobenzenes
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Halobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Fluorobenzenes
Alternative Parents
N-methylpiperazines Aryl fluorides Thiazolidines Tertiary carboxylic acid amides Trialkylamines Lactams Amino acids and derivatives Dialkylthioethers Azacyclic compounds Organopnictogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Fluorobenzene - N-methylpiperazine - N-alkylpiperazine - Aryl fluoride - Aryl halide - 1,4-diazinane - Piperazine - Tertiary carboxylic acid amide - Thiazolidine - Amino acid or derivatives - Carboxamide group - Lactam - Tertiary amine - Tertiary aliphatic amine - Organoheterocyclic compound - Thioether - Dialkylthioether - Carboxylic acid derivative - Azacycle - Organic oxygen compound - Organohalogen compound - Organofluoride - Organic nitrogen compound - Organonitrogen compound - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - Organopnictogen compound - Amine - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as fluorobenzenes. These are compounds containing one or more fluorine atoms attached to a benzene ring.
External Descriptors
Not available