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Murcko scaffold

Ring system with 3 rings and 18 atoms

5 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
18
Chemicals
5
With full pages
1
Scaffold SMILES

c1nc(Nc2nccs2)cc(N2CCNCC2)n1

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 scaffold
Murcko scaffold c1nc(Nc2nccs2)cc(N2CCNCC2)n1

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 5 of 5 chemicals

Methyl hydroxyethyl piperazinyl methyl pyrimidinylamino thiazolecarboxylate chemical structure, C16H22N6O3S, CAS 1245157-35-0
Methyl hydroxyethyl piperazinyl methyl pyrimidinylamino thiazolecarboxylate
CAS 1245157-35-0C16H22N6O3S
2-((6-(4-(2-Hydroxyethyl)piperazin-1-yl)-2-methylpyrimidin-4-yl)amino)-1,3-thiazole-5-carboxylic acid chemical structure, C15H20N6O3S, CAS 1245157-42-9
2-((6-(4-(2-Hydroxyethyl)piperazin-1-yl)-2-methylpyrimidin-4-yl)amino)-1,3-thiazole-5-carboxylic acid
CAS 1245157-42-9C15H20N6O3S
tert-Butyl 4-(2-methyl-6-((5-vinylthiazol-2-yl)amino)pyrimidin-4-yl)piperazine-1-carboxylate chemical structure, C19H26N6O2S, CAS 936845-86-2
tert-Butyl 4-(2-methyl-6-((5-vinylthiazol-2-yl)amino)pyrimidin-4-yl)piperazine-1-carboxylate
CAS 936845-86-2C19H26N6O2S
4-[6-(5-Formyl-thiazol-2-ylamino)-pyrimidin-4-yl]-piperazine-1-carboxylic acid tert-butyl ester chemical structure, C17H22N6O3S, CAS 936845-92-0
4-[6-(5-Formyl-thiazol-2-ylamino)-pyrimidin-4-yl]-piperazine-1-carboxylic acid tert-butyl ester
CAS 936845-92-0C17H22N6O3S
tert-Butyl 4-(6-((5-formylthiazol-2-yl)amino)-2-methylpyrimidin-4-yl)piperazine-1-carboxylate chemical structure, C18H24N6O3S, CAS 936845-85-1
tert-Butyl 4-(6-((5-formylthiazol-2-yl)amino)-2-methylpyrimidin-4-yl)piperazine-1-carboxylate
CAS 936845-85-1C18H24N6O3S