Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC=C1C1=C(SC2=CN=C(NC3=C(OC(C)C)C=C(C=C3)N(C)CCN3CCCC3)N=C12)C(N)=O

InChIKey

InChIKey=RLJPPYPARTXRJS-UHFFFAOYSA-N

Formula

C30H36N6O3S

Mass

560.72

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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

Pyrimidinecarboxamide - Thienopyrimidine - Aminophenyl ether - Anisole - Phenol ether - 2-heteroaryl carboxamide - Tertiary aliphatic/aromatic amine - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - Dialkylarylamine - Aniline or substituted anilines - Methoxybenzene - Phenoxy compound - Alkyl aryl ether - Aminopyrimidine - N-alkylpyrrolidine - Pyrimidine - Monocyclic benzene moiety - Benzenoid - Thiophene - Heteroaromatic compound - Pyrrolidine - Tertiary aliphatic amine - Carboxamide group - Tertiary amine - Amino acid or derivatives - Primary carboxylic acid amide - Ether - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Amine - Organooxygen compound - Organonitrogen 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

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