Compound Identification
SMILES
COC1=CC(CNC(=S)N2CCCN(CC3=CC=CC=N3)CC2)=CC(OC)=C1OC
InChIKey
InChIKey=FIRCLFVQAVVBSF-UHFFFAOYSA-N
Formula
C22H30N4O3S
Mass
430.57
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 2-pyridylmethylamines Aralkylamines Alkyl aryl ethers 1,4-diazepanes Heteroaromatic compounds Trialkylamines Thioureas Azacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenoxy compound - 2-pyridylmethylamine - Anisole - Methoxybenzene - 1,4-diazepane - Alkyl aryl ether - Aralkylamine - Diazepane - Monocyclic benzene moiety - Pyridine - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Thiourea - Ether - Organoheterocyclic compound - Azacycle - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Amine - 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