Compound Identification
SMILES
CC1=C(Cl)C=CC2=C(NN=C12)C1=NC(C(=O)N2CCNCC2)=C(S1)C1=CN=CC=C1
InChIKey
InChIKey=VPNNAJUACHYEQT-UHFFFAOYSA-N
Formula
C21H19ClN6OS
Mass
438.93
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzopyrazoles
- Subclass Indazoles
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Class
Benzopyrazoles
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzopyrazoles
Subclass
Indazoles
Intermediate Tree Nodes
Not available
Direct Parent
Indazoles
Alternative Parents
Thiazolecarboxamides 2,4,5-trisubstituted thiazoles 2-heteroaryl carboxamides Pyridines and derivatives Piperazines Aryl chlorides Benzenoids Tertiary carboxylic acid amides Pyrazoles Heteroaromatic compounds Amino acids and derivatives Azacyclic compounds Dialkylamines Hydrocarbon derivatives Organic oxides Organooxygen compounds Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indazole - Benzopyrazole - 2-heteroaryl carboxamide - 2,4,5-trisubstituted 1,3-thiazole - Thiazolecarboxylic acid or derivatives - Thiazolecarboxamide - Aryl chloride - Aryl halide - Piperazine - Benzenoid - Pyridine - 1,4-diazinane - Tertiary carboxylic acid amide - Thiazole - Pyrazole - Heteroaromatic compound - Azole - Amino acid or derivatives - Carboxamide group - Secondary amine - Secondary aliphatic amine - Carboxylic acid derivative - Azacycle - Organohalogen compound - Organooxygen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organochloride - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indazoles. These are compounds containing an indazole, which is structurally characterized by a pyrazole fused to a benzene.
External Descriptors
Not available