Structure Information
Structure

Compound Identification

SMILES

C[C@H](Nc1c(c(Cl)nc2ncnn12)-c1c(F)cc(OCCCNC(=O)c2ccc(cc2)C2(N=N2)C(F)(F)F)cc1F)C(F)(F)F

InChIKey

InChIKey=MBBXVWBAPADTPO-LBPRGKRZSA-N

Formula

C26H19ClF8N8O2

Mass

662.93

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Triazolopyrimidines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Triazolopyrimidines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Triazolopyrimidine - Benzoic acid or derivatives - Benzamide - Phenoxy compound - Phenol ether - Benzoyl - Secondary aliphatic/aromatic amine - Halopyrimidine - Halobenzene - Fluorobenzene - Alkyl aryl ether - Benzenoid - Pyrimidine - N-acyl-amine - Monocyclic benzene moiety - Heteroaromatic compound - Triazole - Azole - Carboxamide group - Amino acid or derivatives - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Secondary amine - Ether - Diazirine - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Organochloride - Organohalogen compound - Amine - Alkyl halide - Alkyl fluoride - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as triazolopyrimidines. These are polycyclic aromatic compounds containing triazole ring fused to a pyrimidine ring. Triazole is a five-membered ring consisting of two carbon atoms and three nitrogen atoms. 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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