Compound Identification
SMILES
CSC1=CC=C(C=C1)C1=C(N=C(Cl)N=C1NN)C1=CC=CC=C1
InChIKey
InChIKey=BLMDDFLEWVESHU-UHFFFAOYSA-N
Formula
C17H15ClN4S
Mass
342.85
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
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
Thiophenol ethers Alkylarylthioethers 2-halopyrimidines Imidolactams Benzene and substituted derivatives Aryl chlorides Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Organochlorides Hydrocarbon derivatives Hydrazines and derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
4-phenylpyrimidine - 5-phenylpyrimidine - Aryl thioether - Thiophenol ether - 2-halopyrimidine - Alkylarylthioether - Halopyrimidine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Imidolactam - Benzenoid - Heteroaromatic compound - Azacycle - Sulfenyl compound - Thioether - Organochloride - Organohalogen compound - Hydrazine derivative - Organic nitrogen compound - Organonitrogen compound - Organosulfur compound - Hydrocarbon derivative - 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