Compound Identification
SMILES
CCCCN1C(=S)NC2=C(SC3=C2C=C(C=C3)[N+]([O-])=O)C1=O
InChIKey
InChIKey=DRETXNJVAUBDRT-UHFFFAOYSA-N
Formula
C14H13N3O3S2
Mass
335.4
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
1-benzothiophenes Nitroaromatic compounds Pyrimidones Pyrimidinethiones 2-Thiopyrimidines Benzenoids Vinylogous amides Thiophenes Heteroaromatic compounds Thioureas Lactams Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Hydrocarbon derivatives Organic salts Organonitrogen compounds Organooxygen compounds Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzothiophene - Thienopyrimidine - 1-benzothiophene - Nitroaromatic compound - 2-thiopyrimidine - Pyrimidone - Pyrimidinethione - Thiopyrimidine - Pyrimidine - Benzenoid - Heteroaromatic compound - Thiophene - Vinylogous amide - Organic nitro compound - Thiourea - Lactam - C-nitro compound - Organic oxoazanium - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic salt - Organic oxygen compound - Organic oxide - Organic cation - 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