Compound Identification
SMILES
CC1=NN=C(SCC2=CC=CC=C2)N1NC(=O)C1=CC=C(Br)O1
InChIKey
InChIKey=XQFPOQYZGYDNNT-UHFFFAOYSA-N
Formula
C15H13BrN4O2S
Mass
393.26
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Furans
- Subclass Furoic acid and derivatives
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Class
Furans
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Furans
Subclass
Furoic acid and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Furoic acid and derivatives
Alternative Parents
Alkylarylthioethers Benzene and substituted derivatives Aryl bromides Triazoles Heteroaromatic compounds Sulfenyl compounds Oxacyclic compounds Carboxylic acids and derivatives Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Furoic acid or derivatives - Aryl thioether - Alkylarylthioether - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - 1,2,4-triazole - Carboxylic acid derivative - Oxacycle - Azacycle - Sulfenyl compound - Thioether - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as furoic acid and derivatives. These are aromatic heterocyclic compounds containing a furan ring, which carries a carboxyl group or a derivative thereof.
External Descriptors
Not available