Compound Identification
SMILES
OC[C@@H]1CCOC[C@@]1(NC(=S)NC(=O)C1=CC=CC=C1)C1=CC=CC=C1OC(F)(F)F
InChIKey
InChIKey=LPUDBGGVLIZPTQ-YWZLYKJASA-N
Formula
C21H21F3N2O4S
Mass
454.46
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzoic acids and derivatives
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzoic acids and derivatives
Alternative Parents
Phenoxy compounds Phenol ethers Benzoyl derivatives Oxanes Trihalomethanes Thioureas Oxacyclic compounds Dialkyl ethers Carboxylic acids and derivatives Primary alcohols Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzoic acid or derivatives - Phenoxy compound - Benzoyl - Phenol ether - Oxane - Trihalomethane - Thiourea - Carboxylic acid derivative - Dialkyl ether - Ether - Organoheterocyclic compound - Oxacycle - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Alcohol - Organic oxygen compound - Halomethane - Primary alcohol - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzoic acids and derivatives. These are organic compounds containing a carboxylic acid substituent attached to a benzene ring.
External Descriptors
Not available