Compound Identification
SMILES
CO[C@H]1CN(CC[C@H]1NC(=O)C1=C(Br)C(C#N)=C(C)N1)C1=NC(C2=NC=NN2C)=C(S1)C(O)=O
InChIKey
InChIKey=SKGHVMVIRUTLQL-NEPJUHHUSA-N
Formula
C20H21BrN8O4S
Mass
549.4
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Thiazoles
Intermediate Tree Nodes
Not available
Direct Parent
Thiazolecarboxylic acids and derivatives
Alternative Parents
Pyrrole carboxamides 2,4,5-trisubstituted thiazoles 2-heteroaryl carboxamides Dialkylarylamines Substituted pyrroles Piperidines 2-amino-1,3-thiazoles Aryl bromides Vinylogous halides Triazoles Heteroaromatic compounds Secondary carboxylic acid amides Amino acids Nitriles Dialkyl ethers Azacyclic compounds Carboxylic acids Organic oxides Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-heteroaryl carboxamide - 2,4,5-trisubstituted 1,3-thiazole - Pyrrole-2-carboxamide - Pyrrole-2-carboxylic acid or derivatives - Thiazolecarboxylic acid or derivatives - Dialkylarylamine - Aryl bromide - Aryl halide - Piperidine - Substituted pyrrole - 1,3-thiazol-2-amine - Vinylogous halide - 1,2,4-triazole - Heteroaromatic compound - Pyrrole - Tertiary amine - Secondary carboxylic acid amide - Amino acid - Carboxamide group - Amino acid or derivatives - Azacycle - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Nitrile - Carbonitrile - Hydrocarbon derivative - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Amine - Cyanide - Organic nitrogen compound - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as thiazolecarboxylic acids and derivatives. These are heterocyclic compounds containing a thiazole ring which bears a carboxylic acid group (or a derivative thereof).
External Descriptors
Not available