Compound Identification
SMILES
[O-][N+](=O)C1=CC=C(CN=C(NC(=S)N2CCOCC2)C2=CC=C(Cl)C=C2)C=C1
InChIKey
InChIKey=OXGIFSKFLFKMGS-UHFFFAOYSA-N
Formula
C19H19ClN4O3S
Mass
418.9
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Nitrobenzenes
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Nitrobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Nitrobenzenes
Alternative Parents
Nitroaromatic compounds Chlorobenzenes Morpholines Aryl chlorides Thioureas Oxacyclic compounds Organic oxoazanium compounds Dialkyl ethers Carboximidamides Carboxamidines Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organochlorides Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitrobenzene - Nitroaromatic compound - Halobenzene - Chlorobenzene - Aryl chloride - Aryl halide - Morpholine - Oxazinane - C-nitro compound - Organic nitro compound - Thiourea - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Dialkyl ether - Carboximidamide - Organic 1,3-dipolar compound - Organoheterocyclic compound - Ether - Azacycle - Oxacycle - Carboxylic acid amidine - Organic oxoazanium - Amidine - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic zwitterion - Organic salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro group.
External Descriptors
Not available