Compound Identification
SMILES
CCC1=NN=C(S1)C1C(=N)SC(=CC2=CC=C(O2)[N+]([O-])=O)C1=O
InChIKey
InChIKey=BSVLUFIPBDZJNC-UHFFFAOYSA-N
Formula
C13H10N4O4S2
Mass
350.37
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 Imidothiolactones Thiolanes Thiadiazoles Heteroaromatic compounds Cyclic ketones Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Organic oxoazanium compounds Organic oxides Organic salts Hydrocarbon derivatives Organic zwitterions Organonitrogen compounds Organopnictogen compounds Aldehydes
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitroaromatic compound - 2-nitrofuran - Imidothiolactone - Azole - Thiadiazole - Heteroaromatic compound - Thiolane - Ketone - C-nitro compound - Cyclic ketone - Organic nitro compound - Organic oxoazanium - Oxacycle - Azacycle - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aldehyde - Organic oxide - Organic nitrogen compound - Organic zwitterion - Carbonyl group - Organic oxygen compound - Organopnictogen compound - Organic salt - 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