Compound Identification
SMILES
CN(C)C1=CC(CNCCCSSC2=CC=CC=C2[N+]([O-])=O)=NC(CNCCCSSC2=CC=CC=C2[N+]([O-])=O)=C1
InChIKey
InChIKey=HJHKFNJWDZYZDQ-UHFFFAOYSA-N
Formula
C27H34N6O4S4
Mass
634.85
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
6-substituted-2-pyridinylmethylamines Dialkylarylamines Nitroaromatic compounds Aminopyridines and derivatives Aralkylamines Heteroaromatic compounds Organic disulfides Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Dialkylamines Organic oxoazanium compounds Organic salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
6-substituted-2-pyridinylmethylamine - Nitrobenzene - 2-pyridylmethylamine - Nitroaromatic compound - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Aminopyridine - Aralkylamine - Pyridine - Heteroaromatic compound - C-nitro compound - Organic disulfide - Organic nitro compound - Tertiary amine - Secondary aliphatic amine - Organic oxoazanium - Azacycle - Secondary amine - Organoheterocyclic compound - Sulfenyl compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organosulfur compound - Amine - Organic oxygen compound - Organic salt - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organic cation - 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