Compound Identification
SMILES
CCN(CC)C1=C(C=C(NC(=S)NC(=O)C2=C(Cl)C=C(F)C=C2)C=C1)S(=O)(=O)NC1=CC=C(OC)C=C1
InChIKey
InChIKey=RDSOEEFGXKHXMI-UHFFFAOYSA-N
Formula
C25H26ClFN4O4S2
Mass
565.08
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
-
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
Aminobenzenesulfonamides 2-halobenzoic acids and derivatives 4-halobenzoic acids and derivatives Sulfanilides Benzenesulfonyl compounds Methoxyanilines Phenoxy compounds Anisoles Benzoyl derivatives Dialkylarylamines Methoxybenzenes Fluorobenzenes Chlorobenzenes Alkyl aryl ethers Organosulfonamides Aryl fluorides Aryl chlorides Aminosulfonyl compounds Vinylogous halides Amino acids and derivatives Thioureas Hydrocarbon derivatives Organofluorides Organic oxides Organochlorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
N-acyl-phenylthiourea - Aminobenzenesulfonamide - Sulfanilide - Benzenesulfonamide - 2-halobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Benzenesulfonyl group - Methoxyaniline - Phenol ether - Phenoxy compound - Benzoyl - Tertiary aliphatic/aromatic amine - Anisole - Methoxybenzene - Aniline or substituted anilines - Dialkylarylamine - Halobenzene - Fluorobenzene - Chlorobenzene - Alkyl aryl ether - Aryl chloride - Organosulfonic acid amide - Aryl halide - Aryl fluoride - Vinylogous halide - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Thiourea - Tertiary amine - Amino acid or derivatives - Ether - Carboxylic acid derivative - Organonitrogen compound - Organic oxygen compound - Organic oxide - Organosulfur compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organohalogen compound - Organochloride - Organofluoride - Aromatic homomonocyclic 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