Compound Identification
SMILES
CNC(=S)NC(=O)C1=C(Cl)N(C(=O)OC(C)(C)C)C2=CC=CC=C12
InChIKey
InChIKey=XXDQBSXSJQCMIS-UHFFFAOYSA-N
Formula
C16H18ClN3O3S
Mass
367.85
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Indoles and derivatives
-
Subclass
Indolecarboxylic acids and derivatives
- Level 5 Indolecarboxylic acids
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Subclass
Indolecarboxylic acids and derivatives
-
Class
Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Indolecarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Indolecarboxylic acids
Alternative Parents
Indolecarboxamides and derivatives Indoles Pyrrole carboxamides Aryl chlorides Benzenoids Substituted pyrroles Vinylogous halides Vinylogous amides Heteroaromatic compounds Thioureas Azacyclic compounds Carboxylic acids and derivatives Organooxygen compounds Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indolecarboxamide derivative - Indolecarboxylic acid - Indole - Pyrrole-3-carboxamide - Pyrrole-1-carboxylic acid or derivatives - Pyrrole-3-carboxylic acid or derivatives - Benzenoid - Substituted pyrrole - Aryl halide - Aryl chloride - Vinylogous amide - Vinylogous halide - Pyrrole - Heteroaromatic compound - Thiourea - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organohalogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indolecarboxylic acids. These are compounds containing a carboxylic acid group linked to an indole.
External Descriptors
Not available