Compound Identification
SMILES
CSC1=CC=C(C=C1)N1C(=O)NC(=O)C=C1C1=CC=C(C=C1)S(N)(=O)=O
InChIKey
InChIKey=WBMJREKQEPOLSS-UHFFFAOYSA-N
Formula
C17H15N3O4S2
Mass
389.44
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 Phenylpyrimidines
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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
Not available
Direct Parent
Phenylpyrimidines
Alternative Parents
Benzenesulfonamides Benzenesulfonyl compounds Thiophenol ethers Alkylarylthioethers Pyrimidones Organosulfonamides Hydropyrimidines Heteroaromatic compounds Vinylogous amides Aminosulfonyl compounds Lactams Ureas Azacyclic compounds Sulfenyl compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
4-phenylpyrimidine - Benzenesulfonamide - Benzenesulfonyl group - Aryl thioether - Thiophenol ether - Pyrimidone - Alkylarylthioether - Monocyclic benzene moiety - Hydropyrimidine - Organosulfonic acid amide - Benzenoid - Vinylogous amide - Aminosulfonyl compound - Heteroaromatic compound - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Sulfonyl - Urea - Lactam - Azacycle - Sulfenyl compound - Thioether - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrimidines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrimidine ring through a CC or CN bond. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.
External Descriptors
Not available