Compound Identification
SMILES
BrC1=CC=C(C=C1)C1=[N+](C(SCC(=O)NNC=C2C=C(Br)C=CC2=O)=NN1)C1=CC=CC=C1
InChIKey
InChIKey=DDSCTPIVFUAAAT-UHFFFAOYSA-O
Formula
C23H18Br2N5O2S
Mass
588.3
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
O-quinomethanes Alkylarylthioethers Bromobenzenes Aryl bromides Vinylogous amides Heteroaromatic compounds Carboxylic acid hydrazides Bromoalkenes Azacyclic compounds Sulfenyl compounds Vinyl bromides Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenyl-1,2,4-triazole - Aryl thioether - O-quinomethane - Quinomethane - Bromobenzene - Halobenzene - Alkylarylthioether - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Vinylogous amide - Carboxylic acid hydrazide - Ketone - Cyclic ketone - Carboxylic acid derivative - Azacycle - Bromoalkene - Haloalkene - Sulfenyl compound - Thioether - Vinyl bromide - Vinyl halide - Organohalogen compound - Organic oxide - Organic oxygen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Organic cation - Aromatic heteromonocyclic 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