Compound Identification
SMILES
CC(SC1=NN=C(CNC2=CC=C(Cl)C=C2)N1CC=C)C(=O)N\N=C\C1=CN=CC=C1
InChIKey
InChIKey=VPPLYVWMUIAZBS-DHRITJCHSA-N
Formula
C21H22ClN7OS
Mass
455.97
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organosulfur compounds
-
Class
Thioethers
- Subclass Aryl thioethers
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Class
Thioethers
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Superclass
Organosulfur compounds
Kingdom
Organic compounds
Superclass
Organosulfur compounds
Class
Thioethers
Subclass
Aryl thioethers
Intermediate Tree Nodes
Not available
Direct Parent
Aryl thioethers
Alternative Parents
Phenylalkylamines Aniline and substituted anilines Alkylarylthioethers Secondary alkylarylamines Chlorobenzenes Pyridines and derivatives Aryl chlorides Triazoles Heteroaromatic compounds Amino acids and derivatives Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aniline or substituted anilines - Aryl thioether - Phenylalkylamine - Chlorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Alkylarylthioether - Aralkylamine - Monocyclic benzene moiety - Aryl halide - Pyridine - Aryl chloride - Benzenoid - Heteroaromatic compound - Azole - 1,2,4-triazole - Amino acid or derivatives - Sulfenyl compound - Organoheterocyclic compound - Secondary amine - Azacycle - Carboxylic acid derivative - Organic oxide - Organohalogen compound - Amine - Organochloride - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as aryl thioethers. These are organosulfur compounds containing a thioether group that is substituted by an aryl group.
External Descriptors
Not available