Compound Identification
SMILES
CCN1C(=O)C(C#N)=C(C)C(C=C2SC(=S)N(CC=C)C2=O)=C1N1CCN(C)CC1
InChIKey
InChIKey=NQVBHQZVFZYMAM-UHFFFAOYSA-N
Formula
C21H25N5O2S2
Mass
443.58
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazinanes
-
Subclass
Piperazines
- Level 5 Pyridinylpiperazines
-
Subclass
Piperazines
-
Class
Diazinanes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazinanes
Subclass
Piperazines
Intermediate Tree Nodes
Not available
Direct Parent
Pyridinylpiperazines
Alternative Parents
N-arylpiperazines 3-pyridinecarbonitriles Dialkylarylamines Pyridinones Aminopyridines and derivatives N-methylpiperazines Methylpyridines Dihydropyridines Thiazolidinethiones Cyclic dithiocarbamic acid esters Heteroaromatic compounds Trialkylamines Amino acids and derivatives Lactams Azacyclic compounds Nitriles Organic oxides Carbonyl compounds Organosulfur compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyridinylpiperazine - N-arylpiperazine - 3-pyridinecarbonitrile - Dialkylarylamine - Pyridinone - Aminopyridine - Dihydropyridine - Methylpyridine - N-methylpiperazine - N-alkylpiperazine - Hydropyridine - Thiazolidinethione - Pyridine - Cyclic dithiocarbamic acid ester - Thiazolidine - Heteroaromatic compound - Dithiocarbamic acid ester - Lactam - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Carboxylic acid derivative - Carbonitrile - Nitrile - Azacycle - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Cyanide - Amine - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyridinylpiperazines. These are compounds containing a pyridinylpiperazine skeleton, which consists of a pyridine linked (not fused) to a piperazine by a bond by a single bond that is not part of a ring.
External Descriptors
Not available