Compound Identification
SMILES
BrC1=CC2=C(C=C1)N(CC1=NNC(=S)N1C1=CC=CC=C1)C1=NC3=CC=CC=C3N=C21
InChIKey
InChIKey=VSAMQOYOKLLXOK-UHFFFAOYSA-N
Formula
C23H15BrN6S
Mass
487.38
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Azoles
-
Subclass
Triazoles
-
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
Quinoxalines N-alkylindoles Pyrrolopyrazines Indoles Substituted pyrroles Pyrazines Benzene and substituted derivatives Aryl bromides Triazolines Heteroaromatic compounds Azacyclic compounds Organosulfur compounds Organonitrogen compounds Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenyl-1,2,4-triazole - N-alkylindole - Quinoxaline - Indole - Indole or derivatives - Pyrrolopyrazine - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Pyrazine - Substituted pyrrole - Benzenoid - Pyrrole - Heteroaromatic compound - Triazoline - Azacycle - Organosulfur compound - Organonitrogen compound - Organobromide - Organohalogen compound - Hydrocarbon derivative - Organic nitrogen 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