Compound Identification
SMILES
COC(=O)C1=C(C)NC(C)=C(C1C)C(=O)OCCCSC1=CC(Cl)=C(Cl)C=C1
InChIKey
InChIKey=ZTIDWJPDMNZISM-UHFFFAOYSA-N
Formula
C20H23Cl2NO4S
Mass
444.37
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyridines and derivatives
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Subclass
Hydropyridines
- Level 5 Dihydropyridines
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Subclass
Hydropyridines
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Class
Pyridines and derivatives
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Hydropyridines
Intermediate Tree Nodes
Dihydropyridines
Direct Parent
Dihydropyridinecarboxylic acids and derivatives
Alternative Parents
Thiophenol ethers Dichlorobenzenes Alkylarylthioethers Aryl chlorides Dicarboxylic acids and derivatives Vinylogous amides Methyl esters Enoate esters Sulfenyl compounds Azacyclic compounds Dialkylamines Enamines Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Dihydropyridinecarboxylic acid derivative - Aryl thioether - 1,2-dichlorobenzene - Thiophenol ether - Chlorobenzene - Alkylarylthioether - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Carboxylic acid ester - Sulfenyl compound - Thioether - Carboxylic acid derivative - Secondary aliphatic amine - Azacycle - Enamine - Amine - Organic oxide - Organosulfur compound - Hydrocarbon derivative - Organooxygen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as dihydropyridinecarboxylic acids and derivatives. These are compounds containing a dihydropyridine moiety bearing a carboxylic acid group.
External Descriptors
Not available