Compound Identification
SMILES
CCCCC1=C(C(SSC2=C(C=CC(CCCC)=C2C(F)(F)F)C(N)=O)=C(C=C1)C(N)=O)C(F)(F)F
InChIKey
InChIKey=YINXGEOSQDZZIC-UHFFFAOYSA-N
Formula
C24H26F6N2O2S2
Mass
552.59
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Sulfanylbenzoic acids and derivatives
Direct Parent
O-sulfanylbenzoic acids and derivatives
Alternative Parents
Trifluoromethylbenzenes Benzamides Benzoyl derivatives Primary carboxylic acid amides Organic disulfides Sulfenyl compounds Organooxygen compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Trifluoromethylbenzene - O-sulfanylbenzoic acid or derivatives - Benzamide - Benzoyl - Carboxamide group - Organic disulfide - Primary carboxylic acid amide - Carboxylic acid derivative - Sulfenyl compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl halide - Hydrocarbon derivative - Alkyl fluoride - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as o-sulfanylbenzoic acids and derivatives. These are benzoic acids (or derivatives) which bear a sulfanyl group (R-SH) attached to the benzene ring at positions 1 and 2, respectively.
External Descriptors
Not available