Compound Identification
SMILES
CC(OC1=C(Cl)C=C(Cl)C=C1)C(=O)NC(=S)NC1=C(C=CC(=C1)C(F)(F)F)N1CCOCC1
InChIKey
InChIKey=CJMRRISWZMYECF-UHFFFAOYSA-N
Formula
C21H20Cl2F3N3O3S
Mass
522.36
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
N-phenylthioureas
- Level 5 N-acyl-phenylthioureas
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Subclass
N-phenylthioureas
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Class
Benzene and substituted derivatives
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Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
N-phenylthioureas
Intermediate Tree Nodes
Not available
Direct Parent
N-acyl-phenylthioureas
Alternative Parents
Phenylmorpholines Trifluoromethylbenzenes Phenoxy compounds Phenol ethers Aniline and substituted anilines Dialkylarylamines Dichlorobenzenes Alkyl aryl ethers Aryl chlorides Thioureas Amino acids and derivatives Oxacyclic compounds Azacyclic compounds Dialkyl ethers Alkyl fluorides Organic oxides Organochlorides Carbonyl compounds Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-acyl-phenylthiourea - Phenylmorpholine - Trifluoromethylbenzene - 1,3-dichlorobenzene - Phenoxy compound - Phenol ether - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Alkyl aryl ether - Chlorobenzene - Halobenzene - Oxazinane - Aryl chloride - Aryl halide - Morpholine - Tertiary amine - Thiourea - Amino acid or derivatives - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Dialkyl ether - Ether - Hydrocarbon derivative - Alkyl halide - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Alkyl fluoride - Organochloride - Carbonyl group - Organofluoride - Organonitrogen compound - Organooxygen compound - Amine - Organosulfur compound - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-phenylthioureas. These are thiourea derivatives where one nitrogen atom of the urea group is linked to a phenyl group and the other is acylated.
External Descriptors
Not available