Compound Identification
SMILES
CCC(=O)N(C)C1=CC=C(C=C1)C1=C(CN(C)CC2=CC=CC=C2)C2=C(S1)N(CC1=C(F)C=CC=C1F)C(=O)N(C2=O)C1=CC(OC)=CC=C1
InChIKey
InChIKey=QMNVBIOUMGUBCW-UHFFFAOYSA-N
Formula
C39H36F2N4O4S
Mass
694.8
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
Anilides Methoxyanilines Phenylmethylamines Phenoxy compounds Anisoles Methoxybenzenes Benzylamines Alkyl aryl ethers Pyrimidones Aralkylamines Fluorobenzenes Aryl fluorides Vinylogous amides Thiophenes Tertiary carboxylic acid amides Heteroaromatic compounds Ureas Amino acids and derivatives Trialkylamines Lactams Azacyclic compounds Organic oxides Organofluorides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thienopyrimidine - Anilide - Methoxyaniline - Phenylmethylamine - Phenol ether - Phenoxy compound - Anisole - Methoxybenzene - Benzylamine - Alkyl aryl ether - Aralkylamine - Fluorobenzene - Pyrimidone - Halobenzene - Benzenoid - Pyrimidine - Monocyclic benzene moiety - Aryl halide - Aryl fluoride - Heteroaromatic compound - Vinylogous amide - Thiophene - Tertiary carboxylic acid amide - Tertiary amine - Amino acid or derivatives - Tertiary aliphatic amine - Carboxamide group - Urea - Lactam - Ether - Carboxylic acid derivative - Azacycle - Amine - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen 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