Compound Identification
SMILES
CCOC(=O)N1CCN(CC2=C(SC3=CC=CC(F)=C23)C(=O)OCC)CC1
InChIKey
InChIKey=XAFVZRKSDVJKKF-UHFFFAOYSA-N
Formula
C19H23FN2O4S
Mass
394.46
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazinanes
- Subclass Piperazines
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Class
Diazinanes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazinanes
Subclass
Piperazines
Intermediate Tree Nodes
Piperazine carboxylic acids and derivatives
Direct Parent
Piperazine carboxylic acids
Alternative Parents
1-benzothiophenes Thiophene carboxylic acids and derivatives N-alkylpiperazines Aralkylamines Benzenoids Aryl fluorides Heteroaromatic compounds Carbamate esters Trialkylamines Carboxylic acid esters Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzothiophene - 1-benzothiophene - Piperazine-1-carboxylic acid - Thiophene carboxylic acid or derivatives - Aralkylamine - N-alkylpiperazine - Aryl fluoride - Aryl halide - Benzenoid - Heteroaromatic compound - Carbamic acid ester - Thiophene - Amino acid or derivatives - Carboxylic acid ester - Tertiary amine - Tertiary aliphatic amine - Carboxylic acid derivative - Azacycle - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Amine - Carbonyl group - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as piperazine carboxylic acids. These are heterocyclic compounds containing a piperazine ring substituted by one or more carboxylic acid groups.
External Descriptors
Not available