Compound Identification
SMILES
CC1=NNC(C2=C(Cl)C3=C(S2)C=C(F)C=C3)=C2C=C3OC(=O)N=C3C=C2C1
InChIKey
InChIKey=ZBSPPXUHQCCSKZ-UHFFFAOYSA-N
Formula
C19H11ClFN3O2S
Mass
399.82
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-benzothiophenes
Alternative Parents
Benzenoids Aryl fluorides Aryl chlorides Thiophenes Heteroaromatic compounds Oxacyclic compounds Hydrazones Azacyclic compounds Organofluorides Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-benzothiophene - Aryl chloride - Aryl fluoride - Aryl halide - Benzenoid - Thiophene - Heteroaromatic compound - Hydrazone - Oxacycle - Azacycle - Organooxygen compound - Organonitrogen compound - Organofluoride - Organochloride - Organohalogen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1-benzothiophenes. These are aromatic heterocyclic compound containing the Benzo[b]thiophene ring system.
External Descriptors
Not available