Compound Identification
SMILES
COC1=C(\C=N\NC(=O)C2=C(CN3CCCC3)N=NN2C2=NON=C2N)C(Br)=CC(OCC2=CC=C(F)C=C2)=C1
InChIKey
InChIKey=SCKIEBFDZZUCPV-XKJRVUDJSA-N
Formula
C25H25BrFN9O4
Mass
614.436
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 Alkyl aryl ethers Aralkylamines Bromobenzenes Fluorobenzenes Aryl bromides Aryl fluorides N-alkylpyrrolidines Imidolactams Triazoles Heteroaromatic compounds Furazans Trialkylamines Amino acids and derivatives Oxacyclic compounds Azacyclic compounds Organic oxides Organobromides Organofluorides Primary amines Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Anisole - Phenoxy compound - Methoxybenzene - Alkyl aryl ether - Bromobenzene - Fluorobenzene - Halobenzene - Aralkylamine - Aryl bromide - Aryl fluoride - Imidolactam - N-alkylpyrrolidine - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - 1,2,3-triazole - Azole - Pyrrolidine - Oxadiazole - Furazan - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Organonitrogen compound - Amine - Primary amine - Hydrocarbon derivative - Organic oxide - Organobromide - Organofluoride - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Organohalogen compound - Aromatic heteromonocyclic 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