Compound Identification
SMILES
BrC1=CN(C=C1)C(=O)N[C@@H]1C[C@H]2CCN(C2)C1
InChIKey
InChIKey=VCCXHIUUOXYHND-MWLCHTKSSA-N
Formula
C12H16BrN3O
Mass
298.184
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrroles
-
Subclass
Pyrrole carboxylic acids and derivatives
- Level 5 Pyrrole carboxamides
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Subclass
Pyrrole carboxylic acids and derivatives
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Class
Pyrroles
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrroles
Subclass
Pyrrole carboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Pyrrole carboxamides
Alternative Parents
Azepanes Substituted pyrroles Piperidines N-alkylpyrrolidines Aryl bromides Heteroaromatic compounds Ureas Trialkylamines Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrrole-1-carboxamide - Azepane - Aryl bromide - Aryl halide - Piperidine - Substituted pyrrole - N-alkylpyrrolidine - Pyrrolidine - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Urea - Azacycle - Amine - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrrole carboxamides. These are heterocyclic compounds containing a pyrrole ring bearing a carboxamide.
External Descriptors
Not available