Compound Identification
SMILES
CC1=C(NC2=C(C#N)C(N)=C(S2)C(=O)C2=CC3=C(O2)C=CC(Cl)=C3)C=CC(Cl)=C1
InChIKey
InChIKey=NQDRSEQLRQZOHD-UHFFFAOYSA-N
Formula
C21H13Cl2N3O2S
Mass
442.31
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzofurans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzofurans
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzofurans
Alternative Parents
3,4,5-trisubstituted-2-aminothiophenes Thiophene carboxylic acids and derivatives Aniline and substituted anilines Aryl ketones Toluenes Chlorobenzenes N-arylated-2-aminothiophenes Aryl chlorides Vinylogous amides Furans Heteroaromatic compounds Secondary amines Oxacyclic compounds Nitriles Organochlorides Organic oxides Primary amines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzofuran - 3,4,5-trisubstituted-2-aminothiophene - Thiophene carboxylic acid or derivatives - Aryl ketone - Aniline or substituted anilines - Chlorobenzene - Halobenzene - Toluene - N-arylated-2-aminothiophene - 2-aminothiophene - Benzenoid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Aminothiophene - Heteroaromatic compound - Vinylogous amide - Thiophene - Furan - Ketone - Oxacycle - Secondary amine - Carbonitrile - Nitrile - Organic oxide - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Amine - Organic nitrogen compound - Primary amine - Organic oxygen compound - Hydrocarbon derivative - Cyanide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzofurans. These are organic compounds containing a benzene ring fused to a furan. Furan is a five-membered aromatic ring with four carbon atoms and one oxygen atom.
External Descriptors
Not available