Compound Identification
SMILES
CCN(CC)C(=O)C1=C(C)C(C(=O)OC)=C(NC(=S)NC2=C(OC(F)F)C=CC(C)=C2)S1
InChIKey
InChIKey=VODAYZFRDQXYAV-UHFFFAOYSA-N
Formula
C21H25F2N3O4S2
Mass
485.56
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
2-heteroaryl carboxamides Phenol ethers Thiophene carboxamides Phenoxy compounds Toluenes Vinylogous amides Heteroaromatic compounds Methyl esters Tertiary carboxylic acid amides Thioureas Organofluorides Organic oxides Alkyl fluorides Organonitrogen compounds Organooxygen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-phenylthiourea - 2-heteroaryl carboxamide - Phenoxy compound - Phenol ether - Thiophene carboxylic acid or derivatives - Thiophene carboxamide - Toluene - Heteroaromatic compound - Tertiary carboxylic acid amide - Vinylogous amide - Methyl ester - Thiophene - Carboxamide group - Carboxylic acid ester - Thiourea - Carboxylic acid derivative - Organoheterocyclic compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxide - Organic oxygen compound - Alkyl fluoride - Organic nitrogen compound - Hydrocarbon derivative - Alkyl halide - Aromatic heteromonocyclic 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