Compound Identification
SMILES
C[C@H](SC1=NN=CN1C1=CC(Cl)=C(C)C=C1)C(=O)C1=CNC2=CC=CC=C12
InChIKey
InChIKey=VYGKWDKNFHILNU-ZDUSSCGKSA-N
Formula
C20H17ClN4OS
Mass
396.89
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Azoles
-
Subclass
Triazoles
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Level 5
Phenyltriazoles
- Level 6 Phenyl-1,2,4-triazoles
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Level 5
Phenyltriazoles
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Subclass
Triazoles
-
Class
Azoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Triazoles
Intermediate Tree Nodes
Phenyltriazoles
Direct Parent
Phenyl-1,2,4-triazoles
Alternative Parents
Indoles Aryl alkyl ketones Toluenes Chlorobenzenes Alkylarylthioethers Substituted pyrroles Aryl chlorides Vinylogous amides Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenyl-1,2,4-triazole - Indole or derivatives - Indole - Aryl thioether - Aryl ketone - Aryl alkyl ketone - Toluene - Chlorobenzene - Alkylarylthioether - Halobenzene - Substituted pyrrole - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Heteroaromatic compound - Vinylogous amide - Pyrrole - Ketone - Thioether - Sulfenyl compound - Azacycle - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organosulfur compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenyl-1,2,4-triazoles. These are organic compounds containing a 1,2,4-triazole substituted by a phenyl group.
External Descriptors
Not available