Compound Identification
SMILES
CCN1C=C(Br)C(=N1)C(=O)NC(=S)NC1=C(C#N)C2=C(CC(C)CC2)S1
InChIKey
InChIKey=NPVHXVYBPMGBCY-UHFFFAOYSA-N
Formula
C17H18BrN5OS2
Mass
452.39
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Azoles
-
Subclass
Pyrazoles
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Level 5
Pyrazole carboxylic acids and derivatives
- Level 6 Pyrazole-5-carboxamides
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Level 5
Pyrazole carboxylic acids and derivatives
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Subclass
Pyrazoles
-
Class
Azoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Pyrazoles
Intermediate Tree Nodes
Pyrazole carboxylic acids and derivatives
Direct Parent
Pyrazole-5-carboxamides
Alternative Parents
Aryl bromides Vinylogous halides Thiophenes Heteroaromatic compounds Thioureas Nitriles Carboxylic acids and derivatives Azacyclic compounds Organooxygen compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrazole-5-carboxamide - Aryl bromide - Aryl halide - Thiophene - Vinylogous halide - Heteroaromatic compound - Thiourea - Carboxylic acid derivative - Carbonitrile - Nitrile - Azacycle - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Cyanide - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrazole-5-carboxamides. These are compounds containing a pyrazole ring that carries a carboxamide group at the 4-position.
External Descriptors
Not available