Compound Identification
SMILES
CN1C(=O)C(C#N)=C(C)C(\C=C2\SC(=S)N(C3CCS(=O)(=O)C3)C2=O)=C1N1CCN(CC2=CC=CC=C2)CC1
InChIKey
InChIKey=AHBIZDITBLLAQB-OEAKJJBVSA-N
Formula
C27H29N5O4S3
Mass
583.74
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 3-pyridinecarbonitriles Phenylmethylamines Benzylamines Dialkylarylamines Pyridinones Aminopyridines and derivatives Aralkylamines N-alkylpiperazines Methylpyridines Dihydropyridines Thiazolidinethiones Thiolanes Sulfones Cyclic dithiocarbamic acid esters Heteroaromatic compounds Trialkylamines Amino acids and derivatives Lactams Azacyclic compounds Nitriles Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyridinylpiperazine - N-arylpiperazine - Benzylamine - Phenylmethylamine - 3-pyridinecarbonitrile - Dialkylarylamine - Aminopyridine - Pyridinone - Dihydropyridine - Methylpyridine - N-alkylpiperazine - Aralkylamine - Monocyclic benzene moiety - Thiazolidinethione - Pyridine - Hydropyridine - Benzenoid - Thiolane - Cyclic dithiocarbamic acid ester - Thiazolidine - Heteroaromatic compound - Sulfone - Dithiocarbamic acid ester - Amino acid or derivatives - Lactam - Tertiary aliphatic amine - Tertiary amine - Nitrile - Carbonitrile - Carboxylic acid derivative - Azacycle - Organooxygen compound - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Carbonyl group - Cyanide - Organic oxygen compound - Organosulfur compound - Organic nitrogen 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