Compound Identification
SMILES
CCC1=CC2=C(S1)N=CN(NC(=O)C1=CC3=C(S1)N=C1SC=CN31)C2=O
InChIKey
InChIKey=TVFXKHWAROYQPE-UHFFFAOYSA-N
Formula
C16H11N5O2S3
Mass
401.48
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
Thiophene carboxamides Thienoimidazoles 2,3,5-trisubstituted thiophenes Pyrimidones N-substituted imidazoles Thiazoles Heteroaromatic compounds Lactams Carboxylic acids and derivatives Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thienopyrimidine - Thienoimidazole - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - 2,3,5-trisubstituted thiophene - Pyrimidone - N-substituted imidazole - Pyrimidine - Heteroaromatic compound - Imidazole - Thiophene - Thiazole - Azole - Lactam - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - 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