Compound Identification
SMILES
OC(=O)\C=C/C(O)=O.CCCNC1CCN(CC1)C1CCSC2=CC=CC=C12
InChIKey
InChIKey=RUHCRTFAQOHGHT-BTJKTKAUSA-N
Formula
C21H30N2O4S
Mass
406.54
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Thiochromanes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thiochromanes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Thiochromanes
Alternative Parents
1-benzothiopyrans Aralkylamines Aminopiperidines Alkylarylthioethers Unsaturated fatty acids Thiopyrans Dicarboxylic acids and derivatives Benzenoids Trialkylamines Dialkylamines Carboxylic acids Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Not available
Substituents
Thiochromane - 1-benzothiopyran - Benzothiopyran - Aryl thioether - 4-aminopiperidine - Alkylarylthioether - Aralkylamine - Dicarboxylic acid or derivatives - Piperidine - Thiopyran - Unsaturated fatty acid - Benzenoid - Fatty acid - Fatty acyl - Tertiary aliphatic amine - Tertiary amine - Azacycle - Thioether - Secondary aliphatic amine - Secondary amine - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organonitrogen compound - Amine - Carbonyl group - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as thiochromanes. These are organic heterocyclic compounds containing a thiochromane moiety.
External Descriptors
Not available