Compound Identification
SMILES
C[C@@H](NC(=S)NC1=CC=C(Cl)C=C1)C1=CC2=C(OCCO2)C=C1
InChIKey
InChIKey=XRIMAHDPCZRGCK-LLVKDONJSA-N
Formula
C17H17ClN2O2S
Mass
348.85
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
Benzo-1,4-dioxanes Chlorobenzenes Alkyl aryl ethers Para dioxins Aryl chlorides Thioureas Oxacyclic compounds Organonitrogen compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-1,4-dioxane - Benzodioxane - N-phenylthiourea - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Para-dioxin - Thiourea - Ether - Organoheterocyclic compound - Oxacycle - Organochloride - Organohalogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organonitrogen compound - 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