Compound Identification
SMILES
CC1=C(C(N2C(SC(=CC3=C(O)C=CC(Br)=C3)C2=O)=N1)C1=CC=CS1)C(=O)NC1=CC=CC=C1
InChIKey
InChIKey=DXIILHBXORPWLS-UHFFFAOYSA-N
Formula
C25H18BrN3O3S2
Mass
552.46
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazines
-
Subclass
Pyrimidines and pyrimidine derivatives
-
Level 5
Pyrimidinecarboxylic acids and derivatives
- Level 6 Pyrimidinecarboxamides
-
Level 5
Pyrimidinecarboxylic acids and derivatives
-
Subclass
Pyrimidines and pyrimidine derivatives
-
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
Anilides P-bromophenols N-arylamides 1-hydroxy-2-unsubstituted benzenoids Bromobenzenes Aryl bromides Thiophenes Thiazoles Heteroaromatic compounds Secondary carboxylic acid amides Lactams Isothioureas Azacyclic compounds Organobromides Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Anilide - Pyrimidinecarboxamide - 4-halophenol - N-arylamide - 4-bromophenol - 1-hydroxy-2-unsubstituted benzenoid - Halobenzene - Bromobenzene - Phenol - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - Thiophene - Thiazole - Carboxamide group - Lactam - Isothiourea - Secondary carboxylic acid amide - Azacycle - Carboxylic acid derivative - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organobromide - Organohalogen 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