Compound Identification
SMILES
CCOC1=CC=CC=C1NC1=NN=C(SC(C)C(=O)NC2=C(Cl)C=C(C=C2)[N+]([O-])=O)S1
InChIKey
InChIKey=UDMWDJHOFJDFNB-UHFFFAOYSA-N
Formula
C19H18ClN5O4S2
Mass
479.95
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
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Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Nitrobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Nitrobenzenes
Alternative Parents
Anilides Phenoxy compounds Phenol ethers Aniline and substituted anilines N-arylamides Nitroaromatic compounds 2-amino-5-substituted-1,3,4-thiadiazoles Alkyl aryl ethers Alkylarylthioethers Chlorobenzenes Aryl chlorides Heteroaromatic compounds Amino acids and derivatives Secondary carboxylic acid amides Organic oxoazanium compounds Azacyclic compounds Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Secondary amines Organic salts Hydrocarbon derivatives Organic zwitterions Carbonyl compounds Organochlorides Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitrobenzene - Anilide - N-arylamide - Phenoxy compound - Aryl thioether - Nitroaromatic compound - Phenol ether - Aniline or substituted anilines - Alkyl aryl ether - Alkylarylthioether - Halobenzene - 2-amino-5-substituted-1,3,4-thiadiazole - Chlorobenzene - 2-amino-1,3,4-thiadiazole - Aryl halide - Aryl chloride - Heteroaromatic compound - Thiadiazole - Azole - Amino acid or derivatives - Carboxamide group - Organic nitro compound - C-nitro compound - Secondary carboxylic acid amide - Allyl-type 1,3-dipolar organic compound - Secondary amine - Organic 1,3-dipolar compound - Sulfenyl compound - Thioether - Propargyl-type 1,3-dipolar organic compound - Azacycle - Organic oxoazanium - Carboxylic acid derivative - Ether - Organoheterocyclic compound - Organic zwitterion - Organic oxygen compound - Organic salt - Organic nitrogen compound - Organohalogen compound - Amine - Carbonyl group - Organochloride - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Organosulfur 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