Compound Identification
SMILES
CC1=C(CN2C(=NC3=CN=CN=C23)C(F)(F)F)C=CC=C1SCCOC(=O)NC1=CC=CC=C1
InChIKey
InChIKey=BJNKVXXGJWUZAL-UHFFFAOYSA-N
Formula
C23H20F3N5O2S
Mass
487.5
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylcarbamic acid esters
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylcarbamic acid esters
Intermediate Tree Nodes
Not available
Direct Parent
Phenylcarbamic acid esters
Alternative Parents
Purines and purine derivatives Thiophenol ethers Toluenes Alkylarylthioethers Pyrimidines and pyrimidine derivatives N-substituted imidazoles Carbamate esters Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organofluorides Organonitrogen compounds Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylcarbamic acid ester - Imidazopyrimidine - Purine - Aryl thioether - Thiophenol ether - Alkylarylthioether - Toluene - N-substituted imidazole - Pyrimidine - Azole - Imidazole - Heteroaromatic compound - Carbamic acid ester - Azacycle - Organoheterocyclic compound - Thioether - Sulfenyl compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Alkyl fluoride - Alkyl halide - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylcarbamic acid esters. These are ester derivatives of phenylcarbamic acids.
External Descriptors
Not available