Compound Identification
SMILES
CCSCCOC(=O)C1=C(C)NC(=O)NC1C1=CC=C(OC(F)(F)F)C=C1
InChIKey
InChIKey=NXGUFZBGEYIBFQ-UHFFFAOYSA-N
Formula
C17H19F3N2O4S
Mass
404.4
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Diazines
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Subclass
Pyrimidines and pyrimidine derivatives
- Level 5 Hydropyrimidines
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Subclass
Pyrimidines and pyrimidine derivatives
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Class
Diazines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazines
Subclass
Pyrimidines and pyrimidine derivatives
Intermediate Tree Nodes
Hydropyrimidines
Direct Parent
Hydropyrimidine carboxylic acids and derivatives
Alternative Parents
Phenol ethers Phenoxy compounds Pyrimidones Enoate esters Vinylogous amides Ureas Trihalomethanes Azacyclic compounds Monocarboxylic acids and derivatives Dialkylthioethers Sulfenyl compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Hydropyrimidine carboxylic acid derivative - Phenoxy compound - Phenol ether - Pyrimidone - Monocyclic benzene moiety - Benzenoid - Vinylogous amide - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Trihalomethane - Urea - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Thioether - Azacycle - Sulfenyl compound - Dialkylthioether - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl halide - Organic oxide - Organic oxygen compound - Halomethane - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Alkyl fluoride - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as hydropyrimidine carboxylic acids and derivatives. These are compounds containing a hydrogenated pyrimidine ring which bears a carboxylic acid group.
External Descriptors
Not available