Compound Identification
SMILES
CNC1=C2C(SC3=C2N=CN(C2CCCCC2)C3=O)=NC=C1[N+]([O-])=O
InChIKey
InChIKey=CCNULVQZPOXAAS-UHFFFAOYSA-N
Formula
C16H17N5O3S
Mass
359.4
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Thienopyrimidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thienopyrimidines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Thienopyrimidines
Alternative Parents
Thienopyridines Nitroaromatic compounds Secondary alkylarylamines Pyrimidones Aminopyridines and derivatives Thiophenes Heteroaromatic compounds Lactams Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxides Organic zwitterions Hydrocarbon derivatives Organooxygen compounds Organic salts
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thienopyridine - Thienopyrimidine - Nitroaromatic compound - Aminopyridine - Pyrimidone - Secondary aliphatic/aromatic amine - Pyridine - Pyrimidine - Heteroaromatic compound - Thiophene - Lactam - C-nitro compound - Organic nitro compound - Organic 1,3-dipolar compound - Secondary amine - Azacycle - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Amine - Organic zwitterion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as thienopyrimidines. These are heterocyclic compounds containing a thiophene ring fused to a pyrimidine ring. Thiophene is 5-membered ring consisting of four carbon atoms and one sulfur atom. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.
External Descriptors
Not available