Compound Identification
SMILES
CSC1=NC=C(Cl)C(=N1)C(=O)N1CCC(CC1)C1=NC(=CS1)C1=CC(=C(Cl)C=C1)[N+]([O-])=O
InChIKey
InChIKey=ZYHDLYAVMNGZGX-UHFFFAOYSA-N
Formula
C20H17Cl2N5O3S2
Mass
510.41
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Diazines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazines
Subclass
Pyrimidines and pyrimidine derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Pyrimidinecarboxylic acids and derivatives
Alternative Parents
N-acylpiperidines Nitrobenzenes 2-heteroaryl carboxamides Nitroaromatic compounds 2,4-disubstituted thiazoles Alkylarylthioethers Chlorobenzenes Halopyrimidines Aryl chlorides Tertiary carboxylic acid amides Heteroaromatic compounds Vinylogous halides Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Sulfenyl compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Organic salts Organochlorides Organonitrogen compounds Organooxygen compounds Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-acyl-piperidine - Nitrobenzene - Pyrimidine-6-carboxylic acid or derivatives - 2-heteroaryl carboxamide - Aryl thioether - Nitroaromatic compound - 2,4-disubstituted 1,3-thiazole - Chlorobenzene - Halobenzene - Halopyrimidine - Alkylarylthioether - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Piperidine - Benzenoid - Azole - Heteroaromatic compound - Vinylogous halide - Tertiary carboxylic acid amide - Thiazole - Carboxamide group - Organic nitro compound - C-nitro compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Sulfenyl compound - Thioether - Carboxylic acid derivative - Organic oxoazanium - Azacycle - Organic oxide - Organosulfur compound - Organic oxygen compound - Organic salt - Organohalogen compound - Organochloride - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organooxygen compound - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyrimidinecarboxylic acids and derivatives. These are compounds containing a pyrimidine ring which bears a carboxylic acid group (or a derivative thereof).
External Descriptors
Not available