Compound Identification
SMILES
CN1C(=O)C(C#N)=C(C)C(\C=C2\SC(=S)N(CC3=CC4=C(OCO4)C=C3)C2=O)=C1N1CCN(CC2=CC=CC=C2)CC1
InChIKey
InChIKey=GJLOTMLNVGZOCK-JFLMPSFJSA-N
Formula
C31H29N5O4S2
Mass
599.72
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 Benzodioxoles Benzylamines Dialkylarylamines 3-pyridinecarbonitriles Phenylmethylamines N-alkylpiperazines Methylpyridines Aminopyridines and derivatives Dihydropyridines Aralkylamines Pyridinones Thiazolidinethiones Heteroaromatic compounds Cyclic dithiocarbamic acid esters Amino acids and derivatives Lactams Trialkylamines Acetals Nitriles Azacyclic compounds Oxacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds Organosulfur compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyridinylpiperazine - N-arylpiperazine - Benzodioxole - Dialkylarylamine - Benzylamine - 3-pyridinecarbonitrile - Phenylmethylamine - Aminopyridine - Pyridinone - N-alkylpiperazine - Aralkylamine - Dihydropyridine - Methylpyridine - Monocyclic benzene moiety - Benzenoid - Thiazolidinethione - Pyridine - Hydropyridine - Thiazolidine - Dithiocarbamic acid ester - Cyclic dithiocarbamic acid ester - Heteroaromatic compound - Amino acid or derivatives - Lactam - Tertiary aliphatic amine - Tertiary amine - Acetal - Azacycle - Oxacycle - Carboxylic acid derivative - Carbonitrile - Nitrile - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Carbonyl group - Cyanide - Organopnictogen compound - Amine - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - 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