Compound Identification
SMILES
FC(F)(F)OC1=CC=C(NC(=S)N2CCC(CC2)N2[C@@H]3[C@@H](CC4=CC=CC=C34)OC2=O)C=C1
InChIKey
InChIKey=XCRAQNCAIVSAOH-UXHICEINSA-N
Formula
C23H22F3N3O3S
Mass
477.5
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
Indanes Phenoxy compounds Phenol ethers Piperidines Oxazolidinones Carbamate esters Trihalomethanes Thioureas Oxacyclic compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organofluorides Organonitrogen compounds Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-phenylthiourea - Indane - Phenoxy compound - Phenol ether - Oxazolidinone - Piperidine - Oxazolidine - Carbamic acid ester - Trihalomethane - Thiourea - Oxacycle - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Halomethane - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Alkyl fluoride - Alkyl halide - Aromatic heteropolycyclic 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