Compound Identification
SMILES
CCSC(=O)CCC1=NN=C(S1)C1=CC=C(O1)[N+]([O-])=O
InChIKey
InChIKey=QCUJKCVXULLNFR-UHFFFAOYSA-N
Formula
C11H11N3O4S2
Mass
313.35
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Furans
- Subclass Nitrofurans
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Class
Furans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Furans
Subclass
Nitrofurans
Intermediate Tree Nodes
Not available
Direct Parent
Nitrofurans
Alternative Parents
Nitroaromatic compounds Thiadiazoles Heteroaromatic compounds Thioesters Carbothioic S-esters Azacyclic compounds Sulfenyl compounds Carboxylic acids and derivatives Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic oxoazanium compounds Carbonyl compounds Organic oxides Hydrocarbon derivatives Organic salts Organonitrogen compounds Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitroaromatic compound - 2-nitrofuran - Azole - Thiadiazole - Heteroaromatic compound - Thiocarboxylic acid ester - Carbothioic s-ester - Organic nitro compound - C-nitro compound - Thiocarboxylic acid or derivatives - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Sulfenyl compound - Azacycle - Oxacycle - Carboxylic acid derivative - Organic nitrogen compound - Carbonyl group - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as nitrofurans. These are compounds containing a furan ring which bears a nitro group.
External Descriptors
Not available