Compound Identification
SMILES
FC1=CC=C(C=C1)N(CCC#N)C(=S)N[C@H]1C[C@H]2CC[C@@H]1C2
InChIKey
InChIKey=VMDPIMJYBDBALL-ZENOOKHLSA-N
Formula
C17H20FN3S
Mass
317.43
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
-
Subclass
Monoterpenoids
- Level 5 Bicyclic monoterpenoids
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Subclass
Monoterpenoids
-
Class
Prenol lipids
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Prenol lipids
Subclass
Monoterpenoids
Intermediate Tree Nodes
Not available
Direct Parent
Bicyclic monoterpenoids
Alternative Parents
N-phenylthioureas Aromatic monoterpenoids Fluorobenzenes Aryl fluorides Thioureas Nitriles Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Aromatic monoterpenoid - Bicyclic monoterpenoid - N-phenylthiourea - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Benzenoid - Monocyclic benzene moiety - Thiourea - Carbonitrile - Nitrile - Organohalogen compound - Organofluoride - Organonitrogen compound - Organosulfur compound - Hydrocarbon derivative - Cyanide - Organic nitrogen compound - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as bicyclic monoterpenoids. These are monoterpenoids containing exactly 2 rings, which are fused to each other.
External Descriptors
Not available