Compound Identification
SMILES
CC1=CC(NC(=O)C2=C(Cl)C3=C(S2)C=C(F)C=C3)=C(C=C1C)[N+]([O-])=O
InChIKey
InChIKey=AFGPANQROIMYDJ-UHFFFAOYSA-N
Formula
C17H12ClFN2O3S
Mass
378.8
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzothiophenes
- Subclass 1-benzothiophenes
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Class
Benzothiophenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzothiophenes
Subclass
1-benzothiophenes
Intermediate Tree Nodes
Not available
Direct Parent
1-benzothiophene-2-carboxanilides
Alternative Parents
Aromatic anilides Nitrobenzenes Nitrotoluenes o-Xylenes Thiophene carboxamides 2-heteroaryl carboxamides Nitroaromatic compounds Aryl chlorides Aryl fluorides Vinylogous halides Heteroaromatic compounds Secondary carboxylic acid amides Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives Organic salts Organochlorides Organofluorides Organonitrogen compounds Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-benzothiophene-2-carboxanilide - Aromatic anilide - Nitrobenzene - Nitrotoluene - 2-heteroaryl carboxamide - Nitroaromatic compound - O-xylene - Xylene - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Vinylogous halide - Thiophene - Carboxamide group - C-nitro compound - Organic nitro compound - Secondary carboxylic acid amide - Carboxylic acid derivative - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic nitrogen compound - Organic oxygen compound - Organochloride - Organofluoride - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1-benzothiophene-2-carboxanilides. These are aromatic heteropolycyclic compounds that contain a 1-benzothiophene ring system, which is substituted with an anilide at the 2-position.
External Descriptors
Not available