Compound Identification
SMILES
Cc1ncc(n1CCOc1cccc(\C=N\Nc2nc(cs2)-c2ccc(cc2)C(F)(F)F)c1)[N+]([O-])=O
InChIKey
InChIKey=ISBIZTANIXDHIA-KVSWJAHQSA-N
Formula
C23H19F3N6O3S
Mass
516.5
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
1,2,5-trisubstituted imidazoles Phenoxy compounds Phenol ethers Nitroaromatic compounds Nitroimidazoles 2,4-disubstituted thiazoles Alkyl aryl ethers N-substituted imidazoles Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Hydrazones Organic oxoazanium compounds Organic zwitterions Organopnictogen compounds Organofluorides Hydrocarbon derivatives Alkyl fluorides Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Trifluoromethylbenzene - 1,2,5-trisubstituted-imidazole - Phenoxy compound - Nitroaromatic compound - Nitroimidazole - Phenol ether - Trisubstituted imidazole - 2,4-disubstituted 1,3-thiazole - Alkyl aryl ether - N-substituted imidazole - Azole - Imidazole - Heteroaromatic compound - Thiazole - Organic nitro compound - C-nitro compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Ether - Hydrazone - Organic oxoazanium - Organic zwitterion - Hydrocarbon derivative - Organohalogen compound - Organic oxide - Organic oxygen compound - Organofluoride - Organonitrogen compound - Organic nitrogen compound - Alkyl halide - Organooxygen compound - Organopnictogen compound - Alkyl fluoride - Aromatic heteromonocyclic 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