Compound Identification
SMILES
OC(=O)C1=C(O)C(=O)N=C(N1)C1=CSC=C1NC(=O)COC1=CC=C(OC(F)(F)F)C=C1
InChIKey
InChIKey=CWAZIIFPWSHTAV-UHFFFAOYSA-N
Formula
C18H12F3N3O7S
Mass
471.36
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
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Level 5
Pyrimidinecarboxylic acids and derivatives
- Level 6 Pyrimidinecarboxylic acids
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Level 5
Pyrimidinecarboxylic acids and derivatives
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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
Pyrimidinecarboxylic acids and derivatives
Direct Parent
Pyrimidinecarboxylic acids
Alternative Parents
Hydropyrimidine carboxylic acids and derivatives Phenoxy compounds Phenol ethers N-arylamides Alkyl aryl ethers Pyrimidones Hydroxypyrimidines Vinylogous amides Vinylogous acids Thiophenes Heteroaromatic compounds Trihalomethanes Secondary carboxylic acid amides Carboxylic acids Azacyclic compounds Hydrocarbon derivatives Alkyl fluorides Carbonyl compounds Organofluorides Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyrimidine-6-carboxylic acid - Hydropyrimidine carboxylic acid derivative - Phenoxy compound - N-arylamide - Phenol ether - Alkyl aryl ether - Pyrimidone - Hydroxypyrimidine - Benzenoid - Monocyclic benzene moiety - Hydropyrimidine - Heteroaromatic compound - Vinylogous amide - Vinylogous acid - Thiophene - Carboxamide group - Secondary carboxylic acid amide - Trihalomethane - Carboxylic acid derivative - Carboxylic acid - Ether - Azacycle - Organohalogen compound - Hydrocarbon derivative - Halomethane - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Organic oxide - Carbonyl group - Organic oxygen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyrimidinecarboxylic acids. These are pyrimidines with a structure containing a carboxyl group attached to the pyrimidine ring.
External Descriptors
Not available