Compound Identification
SMILES
CC[NH+]1CCC[C@@H]1CNC(=S)NC1=CC(F)=C(C)C=C1
InChIKey
InChIKey=ROKCSUVNWRCTSH-CYBMUJFWSA-O
Formula
C15H23FN3S
Mass
296.43
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass N-phenylthioureas
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
N-phenylthioureas
Intermediate Tree Nodes
Not available
Direct Parent
N-phenylthioureas
Alternative Parents
Toluenes Fluorobenzenes N-alkylpyrrolidines Aryl fluorides Quaternary ammonium salts Trialkylamines Thioureas Azacyclic compounds Organofluorides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-phenylthiourea - Fluorobenzene - Halobenzene - Toluene - Aryl fluoride - Aryl halide - N-alkylpyrrolidine - Pyrrolidine - Quaternary ammonium salt - Tertiary amine - Thiourea - Tertiary aliphatic amine - Organoheterocyclic compound - Azacycle - Amine - Organosulfur compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-phenylthioureas. These are compounds containing a N-phenylthiourea moiety, which is structurally characterized by a phenyl group linked to one nitrogen atom of a thiourea group.
External Descriptors
Not available