Compound Identification
SMILES
CCOC(=O)C1=C(C)NC(C)=C(C1C1=CC=CC=C1NC1=NC(=CS1)C1=CC=C(SC)C=C1)C(=O)OCC
InChIKey
InChIKey=PGXCNASLAKAUBE-UHFFFAOYSA-N
Formula
C29H31N3O4S2
Mass
549.7
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 Aniline and substituted anilines 2,4-disubstituted thiazoles Alkylarylthioethers 2-amino-1,3-thiazoles Dicarboxylic acids and derivatives Enoate esters Vinylogous amides Heteroaromatic compounds Amino acids and derivatives Enamines Dialkylamines Azacyclic compounds Sulfenyl compounds Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Dihydropyridinecarboxylic acid derivative - Aryl thioether - Thiophenol ether - Aniline or substituted anilines - 2,4-disubstituted 1,3-thiazole - Alkylarylthioether - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - 1,3-thiazol-2-amine - Azole - Thiazole - Heteroaromatic compound - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous amide - Amino acid or derivatives - Carboxylic acid ester - Azacycle - Sulfenyl compound - Thioether - Carboxylic acid derivative - Secondary aliphatic amine - Enamine - Secondary amine - Organic oxygen compound - Amine - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - 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