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Murcko scaffold

Benzyl 2-((4-oxo-4H-pyrido[1,2-a][1,3,5]triazin-2-yl)thio)acetate scaffold

4 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
23
Chemicals
4
With full pages
4
Scaffold SMILES

O=C(CSc1nc(=O)n2ccccc2n1)OCc1ccccc1

A Bemis-Murcko scaffold is what remains of a molecule when every side chain is removed: the rings and the chains that link them. Chemicals that share a scaffold often belong to the same compound series, which helps when you look for analogues, alternative suppliers or related building blocks.

Substructure search with this scaffoldOpen the Benzyl 2-((4-oxo-4H-pyrido[1,2-a][1,3,5]triazin-2-yl)thio)acetate page
Murcko scaffold O=C(CSc1nc(=O)n2ccccc2n1)OCc1ccccc1

Computed from the structures of the chemicals listed here. Stereo and charges are removed before the scaffold is taken.

Chemicals with this scaffold

Open one to see its structure, properties and suppliers.

Showing 1 to 4 of 4 chemicals

Benzyl 2-((4-oxo-4H-pyrido[1,2-a][1,3,5]triazin-2-yl)thio)acetate chemical structure, C16H13N3O3S, CAS 896331-75-2
Benzyl 2-((4-oxo-4H-pyrido[1,2-a][1,3,5]triazin-2-yl)thio)acetate
CAS 896331-75-2C16H13N3O3S
Benzyl 2-(7-methyl-4-oxopyrido[1,2-a][1,3,5]triazin-2-yl)sulfanylacetate chemical structure, C17H15N3O3S, CAS 896324-39-3
Benzyl 2-(7-methyl-4-oxopyrido[1,2-a][1,3,5]triazin-2-yl)sulfanylacetate
CAS 896324-39-3C17H15N3O3S
Benzyl 2-(8-methyl-4-oxopyrido[1,2-a][1,3,5]triazin-2-yl)sulfanylacetate chemical structure, C17H15N3O3S, CAS 896334-51-3
Benzyl 2-(8-methyl-4-oxopyrido[1,2-a][1,3,5]triazin-2-yl)sulfanylacetate
CAS 896334-51-3C17H15N3O3S
Benzyl 2-(9-methyl-4-oxopyrido[1,2-a][1,3,5]triazin-2-yl)sulfanylacetate chemical structure, C17H15N3O3S, CAS 896345-45-2
Benzyl 2-(9-methyl-4-oxopyrido[1,2-a][1,3,5]triazin-2-yl)sulfanylacetate
CAS 896345-45-2C17H15N3O3S