Compound Identification
SMILES
CCN1C(=O)C(C#N)=C(C)C(C=C2SC(=S)N(CCC3=CC=C(OC)C=C3)C2=O)=C1N1CCN(CCO)CC1
InChIKey
InChIKey=FTRZNNYKAAKUOC-UHFFFAOYSA-N
Formula
C28H33N5O4S2
Mass
567.72
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Diazinanes
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Subclass
Piperazines
- Level 5 Pyridinylpiperazines
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Subclass
Piperazines
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Class
Diazinanes
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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 Anisoles Dialkylarylamines Methoxybenzenes Phenoxy compounds 3-pyridinecarbonitriles Dihydropyridines Aminopyridines and derivatives Pyridinones Methylpyridines N-alkylpiperazines Alkyl aryl ethers Thiazolidinethiones Heteroaromatic compounds Cyclic dithiocarbamic acid esters Lactams Trialkylamines 1,2-aminoalcohols Amino acids and derivatives Nitriles Azacyclic compounds Hydrocarbon derivatives Primary alcohols Organic oxides Carbonyl compounds Organosulfur compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyridinylpiperazine - N-arylpiperazine - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - 3-pyridinecarbonitrile - Dialkylarylamine - Alkyl aryl ether - Aminopyridine - Dihydropyridine - Methylpyridine - N-alkylpiperazine - Pyridinone - Benzenoid - Pyridine - Hydropyridine - Monocyclic benzene moiety - Thiazolidinethione - Cyclic dithiocarbamic acid ester - Heteroaromatic compound - Dithiocarbamic acid ester - Thiazolidine - Tertiary amine - Tertiary aliphatic amine - Amino acid or derivatives - 1,2-aminoalcohol - Lactam - Azacycle - Alkanolamine - Nitrile - Carbonitrile - Carboxylic acid derivative - Ether - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Cyanide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Amine - Organosulfur compound - Alcohol - Primary alcohol - 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