Compound Identification
SMILES
CCOC(=O)C1=NN(C(=O)C2=C(NC(=O)C3=CC(C)=C(C)C=C3)SC=C12)C1=CC=C(C=C1)C(F)(F)F
InChIKey
InChIKey=YBYMQUVECCSULQ-UHFFFAOYSA-N
Formula
C25H20F3N3O4S
Mass
515.51
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Trifluoromethylbenzenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Trifluoromethylbenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Trifluoromethylbenzenes
Alternative Parents
Thieno[3,4-d]pyridazines Benzamides o-Xylenes Benzoyl derivatives Pyridazinones Vinylogous amides Thiophenes Heteroaromatic compounds Secondary carboxylic acid amides Carboxylic acid esters Lactams Azacyclic compounds Hydrocarbon derivatives Organonitrogen compounds Organooxygen compounds Alkyl fluorides Organic oxides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Trifluoromethylbenzene - Benzamide - Benzoic acid or derivatives - Thieno[3,4-d]pyridazine - Thienopyridazine - Benzoyl - O-xylene - Xylene - Pyridazinone - Pyridazine - Vinylogous amide - Thiophene - Heteroaromatic compound - Carboxylic acid ester - Lactam - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organohalogen compound - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as trifluoromethylbenzenes. These are organofluorine compounds that contain a benzene ring substituted with one or more trifluoromethyl groups.
External Descriptors
Not available