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Murcko scaffold

Ring system with 3 rings and 18 atoms

8 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
18
Chemicals
8
With full pages
3
Scaffold SMILES

C1=CN(Cc2cccs2)C=CC1c1ccccc1

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 C1=CN(Cc2cccs2)C=CC1c1ccccc1

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 8 of 8 chemicals

Dimethyl 4-(2,3-dimethoxyphenyl)-1-(thiophen-2-ylmethyl)-1,4-dihydropyridine-3,5-dicarboxylate chemical structure, C22H23NO6S, CAS 347312-14-5
Dimethyl 4-(2,3-dimethoxyphenyl)-1-(thiophen-2-ylmethyl)-1,4-dihydropyridine-3,5-dicarboxylate
CAS 347312-14-5C22H23NO6S
Dimethyl 4-(2,4-dimethoxyphenyl)-1-(thiophen-2-ylmethyl)-1,4-dihydropyridine-3,5-dicarboxylate chemical structure, C22H23NO6S, CAS 347315-45-1
Dimethyl 4-(2,4-dimethoxyphenyl)-1-(thiophen-2-ylmethyl)-1,4-dihydropyridine-3,5-dicarboxylate
CAS 347315-45-1C22H23NO6S
Dimethyl 4-[2-(propan-2-yloxy)phenyl]-1-(thiophen-2-ylmethyl)-1,4-dihydropyridine-3,5-dicarboxylate chemical structure, C23H25NO5S, CAS 443326-31-6
Dimethyl 4-[2-(propan-2-yloxy)phenyl]-1-(thiophen-2-ylmethyl)-1,4-dihydropyridine-3,5-dicarboxylate
CAS 443326-31-6C23H25NO5S
Dimethyl 4-(4-chlorophenyl)-1-(thiophen-2-ylmethyl)-1,4-dihydropyridine-3,5-dicarboxylate chemical structure, C20H18ClNO4S, CAS 346716-59-4
Dimethyl 4-(4-chlorophenyl)-1-(thiophen-2-ylmethyl)-1,4-dihydropyridine-3,5-dicarboxylate
CAS 346716-59-4C20H18ClNO4S
Dimethyl 1-(thiophen-2-ylmethyl)-4-(2,3,4-trimethoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate chemical structure, C23H25NO7S, CAS 347318-99-4
Dimethyl 1-(thiophen-2-ylmethyl)-4-(2,3,4-trimethoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
CAS 347318-99-4C23H25NO7S
Dimethyl 4-(2,5-difluorophenyl)-1-(thiophen-2-ylmethyl)-1,4-dihydropyridine-3,5-dicarboxylate chemical structure, C20H17F2NO4S, CAS 346716-62-9
Dimethyl 4-(2,5-difluorophenyl)-1-(thiophen-2-ylmethyl)-1,4-dihydropyridine-3,5-dicarboxylate
CAS 346716-62-9C20H17F2NO4S
Dimethyl 1-(thiophen-2-ylmethyl)-4-(3,4,5-trimethoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate chemical structure, C23H25NO7S, CAS 346714-83-8
Dimethyl 1-(thiophen-2-ylmethyl)-4-(3,4,5-trimethoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
CAS 346714-83-8C23H25NO7S
Dimethyl 4-(3-chlorophenyl)-1-(2-thienylmethyl)-1,4-dihydro-3,5-pyridinedicarboxylate chemical structure, C20H18ClNO4S, CAS 443325-89-1
Dimethyl 4-(3-chlorophenyl)-1-(2-thienylmethyl)-1,4-dihydro-3,5-pyridinedicarboxylate
CAS 443325-89-1C20H18ClNO4S