Compound Identification
SMILES
CC1=C2SC(=CN2C(=O)N(CC2=CC=CC=C2)C1=O)C(=O)NCC1=CC(F)=C(F)C=C1
InChIKey
InChIKey=XTWQLJRMVRQZIK-UHFFFAOYSA-N
Formula
C22H17F2N3O3S
Mass
441.45
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 Pyrimidinecarboxamides
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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
-
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
Pyrimidinecarboxamides
Alternative Parents
2-heteroaryl carboxamides Thiazolecarboxamides Pyrimidones Fluorobenzenes Aryl fluorides Vinylogous amides Heteroaromatic compounds Ureas Secondary carboxylic acid amides Lactams Azacyclic compounds Hydrocarbon derivatives Organonitrogen compounds Organooxygen compounds Organic oxides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrimidinecarboxamide - 2-heteroaryl carboxamide - Thiazolecarboxamide - Thiazolecarboxylic acid or derivatives - Fluorobenzene - Halobenzene - Pyrimidone - Benzenoid - Monocyclic benzene moiety - Aryl fluoride - Aryl halide - Vinylogous amide - Heteroaromatic compound - Thiazole - Azole - Urea - Carboxamide group - Secondary carboxylic acid amide - Lactam - Azacycle - Carboxylic acid derivative - Organohalogen compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrimidinecarboxamides. These are compounds containing a pyrimidine ring which bears a carboxamide.
External Descriptors
Not available