Compound Identification
SMILES
CC1=NN(CC(=O)NNC(=O)C2=CC=C(Br)S2)C(C)=C1[N+]([O-])=O
InChIKey
InChIKey=WTLOWTDDJVNQMO-UHFFFAOYSA-N
Formula
C12H12BrN5O4S
Mass
402.22
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Thiophenes
-
Subclass
Thiophene carboxylic acids and derivatives
- Level 5 Thiophene carboxamides
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Subclass
Thiophene carboxylic acids and derivatives
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Class
Thiophenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thiophenes
Subclass
Thiophene carboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Thiophene carboxamides
Alternative Parents
Nitroaromatic compounds 2,5-disubstituted thiophenes Aryl bromides Pyrazoles Heteroaromatic compounds Carboxylic acid hydrazides Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Hydrocarbon derivatives Organic oxides Organic salts Carbonyl compounds Organic zwitterions Organobromides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitroaromatic compound - Thiophene carboxamide - 2,5-disubstituted thiophene - Aryl bromide - Aryl halide - Azole - Pyrazole - Heteroaromatic compound - Carboxylic acid hydrazide - C-nitro compound - Organic nitro compound - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Azacycle - Carboxylic acid derivative - Organic oxoazanium - Organic salt - Organonitrogen compound - Organobromide - Organooxygen compound - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Organic zwitterion - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as thiophene carboxamides. These are compounds containing a thiophene ring which bears a carboxamide.
External Descriptors
Not available