Compound Identification
SMILES
CCN1C(=O)C(C#N)=C(C)C(\C=C2\SC(=S)N(CCCCCC(O)=O)C2=O)=C1N1CCN(CC1)C1=CC=CC=C1F
InChIKey
InChIKey=FQICADRIUOKCAG-JJIBRWJFSA-N
Formula
C29H32FN5O4S2
Mass
597.72
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazinanes
-
Subclass
Piperazines
- Level 5 Pyridinylpiperazines
-
Subclass
Piperazines
-
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
Phenylpiperazines N-arylpiperazines Dialkylarylamines Medium-chain fatty acids 3-pyridinecarbonitriles Aniline and substituted anilines Dihydropyridines Fluorobenzenes Halogenated fatty acids Heterocyclic fatty acids Pyridinones Methylpyridines Aminopyridines and derivatives Thiazolidinethiones Aryl fluorides Heteroaromatic compounds Cyclic dithiocarbamic acid esters Lactams Amino acids Nitriles Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Organofluorides Organic oxides Carbonyl compounds Organosulfur compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylpiperazine - Pyridinylpiperazine - N-arylpiperazine - Tertiary aliphatic/aromatic amine - Medium-chain fatty acid - Dialkylarylamine - Aniline or substituted anilines - 3-pyridinecarbonitrile - Aminopyridine - Dihydropyridine - Fluorobenzene - Halobenzene - Halogenated fatty acid - Heterocyclic fatty acid - Pyridinone - Methylpyridine - Thiazolidinethione - Fatty acyl - Monocyclic benzene moiety - Pyridine - Benzenoid - Aryl fluoride - Aryl halide - Hydropyridine - Heteroaromatic compound - Dithiocarbamic acid ester - Thiazolidine - Cyclic dithiocarbamic acid ester - Tertiary amine - Amino acid - Amino acid or derivatives - Lactam - Azacycle - Carboxylic acid derivative - Carboxylic acid - Nitrile - Monocarboxylic acid or derivatives - Carbonitrile - Amine - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organic nitrogen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Cyanide - Carbonyl group - Organic oxygen 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