Structure Information
Structure

Compound Identification

SMILES

[Cl-].COC1=CC=C(C=C1)C1=C(C[NH2+]CC2=CC=CC=C2)C2=C(S1)N(CC1=C(F)C=CC=C1F)C(=O)N(C2=O)C1=CC=CC=C1Cl

InChIKey

InChIKey=ADGXVXNWVIMWQV-UHFFFAOYSA-N

Formula

C34H27Cl2F2N3O3S

Mass

666.56

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Thienopyrimidines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Thienopyrimidines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Thienopyrimidine - Phenoxy compound - Anisole - Phenylmethylamine - Phenol ether - Benzylamine - Methoxybenzene - Pyrimidone - Alkyl aryl ether - Halobenzene - Fluorobenzene - Chlorobenzene - Aralkylamine - Benzenoid - Aryl chloride - Aryl fluoride - Pyrimidine - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Vinylogous amide - Thiophene - Quaternary ammonium salt - Urea - Lactam - Azacycle - Secondary aliphatic amine - Ether - Organic oxygen compound - Organonitrogen compound - Organic salt - Organohalogen compound - Organochloride - Amine - Organic chloride salt - Organofluoride - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen 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

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