Compound Identification
SMILES
CC1=C(C)C=C(OCCOC2=CC=C(C=C3C(=N)N4N=C(CC(=O)N5CCCC5)SC4=NC3=O)C=C2)C=C1
InChIKey
InChIKey=SMNQOUSXVYDRMK-UHFFFAOYSA-N
Formula
C28H29N5O4S
Mass
531.63
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
o-Xylenes N-acylpyrrolidines Phenoxy compounds Alkyl aryl ethers Pyrimidones Imidolactams Hydropyrimidines Tertiary carboxylic acid amides Thiadiazolines N-acylimines Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Amidines Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenoxy compound - O-xylene - Xylene - N-acylpyrrolidine - Phenol ether - Alkyl aryl ether - Pyrimidone - Monocyclic benzene moiety - Hydropyrimidine - 1,4,5,6-tetrahydropyrimidine - Imidolactam - Pyrimidine - Pyrrolidine - Tertiary carboxylic acid amide - Thiadiazoline - N-acylimine - Carboxamide group - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Amidine - Azacycle - Carboxylic acid derivative - Ether - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Organooxygen 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