Compound Identification
SMILES
OC1(NC(=O)NC(C1C(=O)C1=CC=CS1)C1=CC=C(S1)[N+]([O-])=O)C(F)(F)F
InChIKey
InChIKey=RZXUIDSVNDPOSI-UHFFFAOYSA-N
Formula
C14H10F3N3O5S2
Mass
421.37
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Thiophenes
-
Subclass
Nitrothiophenes
- Level 5 2-nitrothiophenes
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Subclass
Nitrothiophenes
-
Class
Thiophenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thiophenes
Subclass
Nitrothiophenes
Intermediate Tree Nodes
Not available
Direct Parent
2-nitrothiophenes
Alternative Parents
Aryl alkyl ketones Nitroaromatic compounds Pyrimidones 2,5-disubstituted thiophenes Diazinanes Heteroaromatic compounds Ureas Fluorohydrins Propargyl-type 1,3-dipolar organic compounds Alkanolamines Azacyclic compounds Organic oxoazanium compounds Organofluorides Alkyl fluorides Organic zwitterions Organopnictogen compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-nitrothiophene - Nitroaromatic compound - Aryl ketone - Aryl alkyl ketone - Pyrimidone - 2,5-disubstituted thiophene - 1,3-diazinane - Pyrimidine - Heteroaromatic compound - Fluorohydrin - Halohydrin - Ketone - C-nitro compound - Carbonic acid derivative - Urea - Organic nitro compound - Alkanolamine - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic oxide - Organofluoride - Organonitrogen compound - Organohalogen compound - Carbonyl group - Alkyl halide - Alkyl fluoride - Organic zwitterion - Organooxygen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 2-nitrothiophenes. These are aromatic heterocyclic compound containing a nitro group attached to a thiophene ring a the 2-position.
External Descriptors
Not available