Compound Identification
SMILES
C\C(N(CC1=C(N)N=C(C)N=C1Cl)C=O)=C(/CCNCCCCCCO)SS\C(CCNCCCCCCO)=C(\C)N(CC1=C(N)N=C(C)N=C1Cl)C=O
InChIKey
InChIKey=IONMAGIPKDVNKQ-WVMMTVHUSA-N
Formula
C36H58Cl2N10O4S2
Mass
829.95
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazines
-
Subclass
Pyrimidines and pyrimidine derivatives
- Level 5 Halopyrimidines
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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
Halopyrimidines
Alternative Parents
Aminopyrimidines and derivatives Aryl chlorides Imidolactams Tertiary carboxylic acid amides Heteroaromatic compounds Amino acids and derivatives Organic disulfides Sulfenyl compounds Alkanolamines Azacyclic compounds Dialkylamines Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Primary alcohols Primary amines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aminopyrimidine - Halopyrimidine - Aryl chloride - Aryl halide - Imidolactam - Tertiary carboxylic acid amide - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - Organic disulfide - Sulfenyl compound - Azacycle - Secondary amine - Alkanolamine - Carboxylic acid derivative - Secondary aliphatic amine - Alcohol - Organohalogen compound - Organochloride - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Primary alcohol - Amine - Primary amine - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as halopyrimidines. These are aromatic compounds containing a halogen atom linked to a pyrimidine ring. 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