Compound Identification
SMILES
COC1=CC(OC)=C(CC(=O)NC(NC(=S)NC2=CC=CC(=C2)C(F)(F)F)C(Cl)(Cl)Cl)C=C1
InChIKey
InChIKey=PRLXIWWMHMIJQK-UHFFFAOYSA-N
Formula
C20H19Cl3F3N3O3S
Mass
544.8
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
Trifluoromethylbenzenes Phenylacetamides Dimethoxybenzenes Phenoxy compounds Anisoles Alkyl aryl ethers Thioureas Secondary carboxylic acid amides Organic oxides Hydrocarbon derivatives Organochlorides Carbonyl compounds Organofluorides Alkyl fluorides Alkyl chlorides Organonitrogen compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Trifluoromethylbenzene - N-phenylthiourea - M-dimethoxybenzene - Dimethoxybenzene - Phenylacetamide - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Carboxamide group - Secondary carboxylic acid amide - Thiourea - Carboxylic acid derivative - Ether - Alkyl fluoride - Organonitrogen compound - Organofluoride - Organochloride - Organohalogen compound - Organic oxide - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Alkyl halide - Hydrocarbon derivative - Alkyl chloride - Aromatic homomonocyclic 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