Compound Identification
SMILES
COC1=CC=C(CCOC2=CC=CC(CC3=CN=C(NCCSCC4=C(C)NC=N4)NC3=O)=C2)C=C1
InChIKey
InChIKey=JRSVLRCHDSZBSO-UHFFFAOYSA-N
Formula
C27H31N5O3S
Mass
505.64
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Phenols
- Subclass Tyrosols and derivatives
-
Class
Phenols
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenols
Subclass
Tyrosols and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Tyrosols and derivatives
Alternative Parents
Phenoxy compounds Methoxybenzenes Anisoles Alkyl aryl ethers Pyrimidones Aminopyrimidines and derivatives Hydropyrimidines Imidazoles Heteroaromatic compounds Lactams Sulfenyl compounds Azacyclic compounds Dialkylthioethers Hydrocarbon derivatives Amines Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Tyrosol derivative - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Aminopyrimidine - Pyrimidone - Monocyclic benzene moiety - Hydropyrimidine - Pyrimidine - Heteroaromatic compound - Azole - Imidazole - Lactam - Azacycle - Thioether - Organoheterocyclic compound - Dialkylthioether - Sulfenyl compound - Ether - Organic oxygen compound - Amine - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Organic oxide - Organosulfur compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as tyrosols and derivatives. These are compounds containing a hydroxyethyl group attached to the C4 carbon of a phenol group.
External Descriptors
Not available