Compound Identification
SMILES
CC(C)C1=C2COC(C)(C)CC2=C(C#N)C(=N1)N1CCN(CC1)C(=S)NC1=CC=CC=C1
InChIKey
InChIKey=KDTWIPNPROSDOL-UHFFFAOYSA-N
Formula
C25H31N5OS
Mass
449.62
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazinanes
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Subclass
Piperazines
- Level 5 Pyridinylpiperazines
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Subclass
Piperazines
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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 Pyranopyridines N-phenylthioureas Dialkylarylamines Aminopyridines and derivatives Imidolactams Heteroaromatic compounds Thioureas Oxacyclic compounds Nitriles Dialkyl ethers Azacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyridinylpiperazine - N-arylpiperazine - N-phenylthiourea - Pyranopyridine - Dialkylarylamine - Aminopyridine - Imidolactam - Benzenoid - Monocyclic benzene moiety - Pyridine - Heteroaromatic compound - Thiourea - Oxacycle - Azacycle - Dialkyl ether - Ether - Carbonitrile - Nitrile - Amine - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organosulfur compound - Organic oxygen compound - Cyanide - Hydrocarbon derivative - Aromatic heteropolycyclic 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