Compound Identification
SMILES
NC1=NC2=C(S1)C(=O)N(C1=CC(=CC=C1)[N+]([O-])=O)C(=S)N2C1=NN=C(S1)C1=CC=CC=C1Cl
InChIKey
InChIKey=SDYIHTKDZPISSW-UHFFFAOYSA-N
Formula
C19H10ClN7O3S3
Mass
515.97
Taxonomic Classification
Taxonomy Tree
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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 Pyrimidones Pyrimidinethiones Chlorobenzenes 2-amino-1,3-thiazoles Aryl chlorides Vinylogous amides Thiadiazoles Heteroaromatic compounds Thioureas Lactams Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organic oxides Hydrocarbon derivatives Organic salts Organic zwitterions Organochlorides Organooxygen compounds Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Nitrobenzene - Nitroaromatic compound - Chlorobenzene - Halobenzene - Pyrimidinethione - Pyrimidone - 1,3-thiazol-2-amine - Pyrimidine - Aryl chloride - Aryl halide - Heteroaromatic compound - Azole - Vinylogous amide - Thiazole - Thiadiazole - Organic nitro compound - Lactam - C-nitro compound - Thiourea - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organonitrogen compound - Organochloride - Organic oxygen compound - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic salt - Organooxygen compound - Organosulfur compound - Primary amine - Organic oxide - Amine - Organic zwitterion - Aromatic heteropolycyclic 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