Compound Identification
SMILES
CCCC1=NC=CC2=C1N=C(S2)C1=C(C)N=C(N[C@H](C)C2=CC=C(OC(F)(F)F)C=C2)N=C1N[C@@H]1C[C@H](CO)[C@@H](O)[C@H]1O
InChIKey
InChIKey=AKZGRBWNQXBUQN-XLIPMNMSSA-N
Formula
C29H33F3N6O4S
Mass
618.68
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Phenol ethers
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenol ethers
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Phenol ethers
Alternative Parents
Phenoxy compounds Aminopyrimidines and derivatives Secondary alkylarylamines Cyclopentanols Imidolactams Pyridines and derivatives Heteroaromatic compounds Thiazoles Trihalomethanes Cyclic alcohols and derivatives Azacyclic compounds Organopnictogen compounds Organofluorides Hydrocarbon derivatives Alkyl fluorides Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenoxy compound - Phenol ether - Aminopyrimidine - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Cyclopentanol - Pyridine - Pyrimidine - Imidolactam - Azole - Cyclic alcohol - Heteroaromatic compound - Thiazole - Secondary alcohol - Trihalomethane - Organoheterocyclic compound - Azacycle - Secondary amine - Alkyl halide - Primary alcohol - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organopnictogen compound - Alkyl fluoride - Organic oxygen compound - Alcohol - Organic nitrogen compound - Halomethane - Amine - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenol ethers. These are aromatic compounds containing an ether group substituted with a benzene ring.
External Descriptors
Not available