Compound Identification
SMILES
COC1=C(OCC2=CC=C(F)C=C2)C(Cl)=CC(C=C2C(=N)N3N=C(SC3=NC2=O)C2=CN=CC=C2)=C1
InChIKey
InChIKey=BTQAGCLYKBSXTC-UHFFFAOYSA-N
Formula
C25H17ClFN5O3S
Mass
521.95
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Phenol ethers
- Subclass Anisoles
-
Class
Phenol ethers
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenol ethers
Subclass
Anisoles
Intermediate Tree Nodes
Not available
Direct Parent
Anisoles
Alternative Parents
Phenoxy compounds Methoxybenzenes Chlorobenzenes Pyrimidones Fluorobenzenes Alkyl aryl ethers Pyridines and derivatives Aryl fluorides Aryl chlorides Hydropyrimidines Imidolactams Thiadiazolines Heteroaromatic compounds N-acylimines Carboxylic acids and derivatives Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Amidines Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenoxy compound - Anisole - Methoxybenzene - Alkyl aryl ether - Halobenzene - Pyrimidone - Fluorobenzene - Chlorobenzene - 1,4,5,6-tetrahydropyrimidine - Hydropyrimidine - Aryl chloride - Monocyclic benzene moiety - Imidolactam - Aryl halide - Aryl fluoride - Pyrimidine - Pyridine - Thiadiazoline - Heteroaromatic compound - N-acylimine - Amidine - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic 1,3-dipolar compound - Ether - Propargyl-type 1,3-dipolar organic compound - Organic oxide - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organochloride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as anisoles. These are organic compounds containing a methoxybenzene or a derivative thereof.
External Descriptors
Not available