Compound Identification
SMILES
OCCNCCNC1=C2C(=O)C3=CC=CC=C3SC2=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=FDVNAMGAICQFIR-UHFFFAOYSA-N
Formula
C17H17N3O4S
Mass
359.4
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Thiochromenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thiochromenes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Thiochromenes
Alternative Parents
1-benzothiopyrans Nitroaromatic compounds Secondary alkylarylamines Benzenoids Vinylogous amides Heteroaromatic compounds 1,2-aminoalcohols Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Dialkylamines Primary alcohols Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thiochromene - 1-benzothiopyran - Benzothiopyran - Nitroaromatic compound - Secondary aliphatic/aromatic amine - Benzenoid - Vinylogous amide - Heteroaromatic compound - Organic nitro compound - 1,2-aminoalcohol - C-nitro compound - Alkanolamine - Secondary aliphatic amine - Organic oxoazanium - Secondary amine - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic nitrogen compound - Primary alcohol - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Amine - Organic oxygen compound - Organic zwitterion - Organic oxide - Alcohol - Organic salt - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as thiochromenes. These are organosulfur compounds that are analogues to chromene, with the difference that a sulfur atom replaces the oxygen atom.
External Descriptors
Not available