Compound Identification
SMILES
COC1=C(OC)C=C(CCN2C(=S)S\C(=C\C3=C(N4CCN(CC4)C4=CC=CC=C4)N(C)C(=O)C(C#N)=C3C)C2=O)C=C1
InChIKey
InChIKey=OPHUBYSCLAEDQR-TURZUDJPSA-N
Formula
C32H33N5O4S2
Mass
615.77
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
Phenylpiperazines N-arylpiperazines Dimethoxybenzenes Anisoles Aniline and substituted anilines Phenoxy compounds 3-pyridinecarbonitriles Dialkylarylamines Pyridinones Alkyl aryl ethers Dihydropyridines Aminopyridines and derivatives Methylpyridines Thiazolidinethiones Heteroaromatic compounds Cyclic dithiocarbamic acid esters Amino acids and derivatives Lactams Nitriles Azacyclic compounds Hydrocarbon derivatives Organosulfur compounds Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylpiperazine - Pyridinylpiperazine - N-arylpiperazine - Dimethoxybenzene - O-dimethoxybenzene - Anisole - Phenol ether - Phenoxy compound - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - 3-pyridinecarbonitrile - Methoxybenzene - Dihydropyridine - Pyridinone - Methylpyridine - Alkyl aryl ether - Aminopyridine - Hydropyridine - Monocyclic benzene moiety - Pyridine - Benzenoid - Thiazolidinethione - Dithiocarbamic acid ester - Heteroaromatic compound - Thiazolidine - Cyclic dithiocarbamic acid ester - Amino acid or derivatives - Tertiary amine - Lactam - Azacycle - Carboxylic acid derivative - Ether - Carbonitrile - Nitrile - Hydrocarbon derivative - Amine - Organic oxygen compound - Cyanide - Carbonyl group - Organosulfur compound - Organooxygen compound - Organic nitrogen compound - Organic oxide - Organonitrogen 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