Compound Identification
SMILES
COC1=C(OC)C=C(C=C1)C1=NC(N2CCN(C)CC2)=C2C(C)=C(SC2=N1)C#N
InChIKey
InChIKey=YOCRZATXEAWCOM-UHFFFAOYSA-N
Formula
C21H23N5O2S
Mass
409.51
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazinanes
-
Subclass
Piperazines
- Level 5 N-arylpiperazines
-
Subclass
Piperazines
-
Class
Diazinanes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazinanes
Subclass
Piperazines
Intermediate Tree Nodes
Not available
Direct Parent
N-arylpiperazines
Alternative Parents
Dimethoxybenzenes Thienopyrimidines Phenoxy compounds Dialkylarylamines Anisoles N-methylpiperazines Aminopyrimidines and derivatives Alkyl aryl ethers Imidolactams Thiophenes Heteroaromatic compounds Trialkylamines Nitriles Azacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-arylpiperazine - Dimethoxybenzene - O-dimethoxybenzene - Thienopyrimidine - Phenoxy compound - Anisole - Dialkylarylamine - Phenol ether - Methoxybenzene - Alkyl aryl ether - N-methylpiperazine - N-alkylpiperazine - Aminopyrimidine - Pyrimidine - Benzenoid - Imidolactam - Monocyclic benzene moiety - Thiophene - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Azacycle - Nitrile - Carbonitrile - Ether - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Cyanide - Organic oxygen compound - Organic nitrogen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-arylpiperazines. These are organic compounds containing a piperazine ring where the nitrogen ring atom carries an aryl group.
External Descriptors
Not available