Structure Information
Structure

Compound Identification

SMILES

COC1=CC(C)=CC2=C1SC(=C2)C1=C2N(N=CN=C2N)C(CN2CCN(CC2)C(C)=O)=C1COCC(N)=O

InChIKey

InChIKey=PWCAKZTVOPLZPY-UHFFFAOYSA-N

Formula

C26H31N7O4S

Mass

537.64

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyrrolotriazines

Subclass

Pyrrolo[2,1-f][1,2,4]triazines

Intermediate Tree Nodes

Not available

Direct Parent

Pyrrolo[2,1-f][1,2,4]triazines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Pyrrolo[2,1-f][1,2,4]triazine - Benzothiophene - 1-benzothiophene - Anisole - Phenol ether - 2,3,5-trisubstituted thiophene - Alkyl aryl ether - Aralkylamine - N-alkylpiperazine - 1,4-diazinane - Piperazine - 1,2,4-triazine - Substituted pyrrole - Imidolactam - Benzenoid - Triazine - Heteroaromatic compound - Pyrrole - Acetamide - Tertiary carboxylic acid amide - Thiophene - Tertiary aliphatic amine - Primary carboxylic acid amide - Tertiary amine - Amino acid or derivatives - Carboxamide group - Azacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organic oxide - Amine - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyrrolo[2,1-f][1,2,4]triazines. These are aromatic heterocyclic compounds containing a pyrrolo[2,1-f][1,2,4]triazine ring system. Pyrrolo[2,1-f][1,2,4]triazine consists of a 1,2,4-triazine ring fused to and sharing the N2-atom with a pyrrole ring.

External Descriptors

Not available

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