Compound Identification
SMILES
CC1=C(C)C2=C(NC3=[N+](N=C(CS3)C3=CC=C(C=C3)[N+](O)=O)C2=O)S1
InChIKey
InChIKey=VCYBZFAGTWAUJU-UHFFFAOYSA-O
Formula
C16H14N4O3S2
Mass
374.43
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
Nitrobenzenes S-alkylisothiosemicarbazones Pyrimidones Alkylarylthioethers Thiosemicarbazones Vinylogous amides Thiophenes Heteroaromatic compounds Lactams Organic nitro compounds N-organohydroxylamines Organic oxoazanium compounds Azacyclic compounds Organic oxides Organooxygen compounds Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Nitrobenzene - Thienopyrimidine - Aryl thioether - S-alkylisothiosemicarbazone - Pyrimidone - Alkylarylthioether - Monocyclic benzene moiety - Pyrimidine - Isothiosemicarbazone - Thiosemicarbazone - Benzenoid - Vinylogous amide - Heteroaromatic compound - Thiophene - Organic nitro compound - Lactam - Azacycle - Organic oxoazanium - N-organohydroxylamine - Thioether - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organic nitrogen compound - 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