Compound Identification
SMILES
COC1=NC=C(CN2CC3CN(CCN(CCOC4=CC=C(C=C4)C#N)S(C)(=O)=O)CC(C2)O3)C=C1
InChIKey
InChIKey=BTSHXCIIAHLBRC-UHFFFAOYSA-N
Formula
C25H33N5O5S
Mass
515.63
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 Benzonitriles Alkyl aryl ethers Aralkylamines Pyridines and derivatives Morpholines Organic sulfonamides Organosulfonamides Aminosulfonyl compounds Heteroaromatic compounds Trialkylamines Dialkyl ethers Oxacyclic compounds Nitriles Azacyclic compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenoxy compound - Benzonitrile - Phenol ether - Alkyl aryl ether - Aralkylamine - Monocyclic benzene moiety - Morpholine - Oxazinane - Pyridine - Organic sulfonic acid amide - Organosulfonic acid amide - Aminosulfonyl compound - Sulfonyl - Heteroaromatic compound - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Dialkyl ether - Oxacycle - Azacycle - Organoheterocyclic compound - Ether - Carbonitrile - Nitrile - Organic oxide - Hydrocarbon derivative - Amine - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Cyanide - Organic nitrogen compound - Organic oxygen compound - 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