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Murcko scaffold

Ring system with 3 rings and 27 atoms

8 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
27
Chemicals
8
With full pages
5
Scaffold SMILES

O=S(=O)(Nc1ccccc1CNCC=Cc1ccccc1)c1ccccc1

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 O=S(=O)(Nc1ccccc1CNCC=Cc1ccccc1)c1ccccc1

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

N-(2-(((3-(4-Chlorophenyl)-2-propen-1-yl)methylamino)methyl)phenyl)-N-(2-hydroxyethyl)-4-methoxybenzenesulfonamide chemical structure, C26H29ClN2O4S, CAS 139298-40-1
N-(2-(((3-(4-Chlorophenyl)-2-propen-1-yl)methylamino)methyl)phenyl)-N-(2-hydroxyethyl)-4-methoxybenzenesulfonamide
CAS 139298-40-1C26H29ClN2O4S
KN-93 chemical structure, C26H29ClN2O4S, CAS 1188890-40-5
KN-93
CAS 1188890-40-5C26H29ClN2O4S
(E)-N-(2-(((3-(4-Chlorophenyl)allyl)(methyl)amino)methyl)phenyl)-4-methoxybenzenesulfonamide chemical structure, C24H25ClN2O3S, CAS 176708-42-2
(E)-N-(2-(((3-(4-Chlorophenyl)allyl)(methyl)amino)methyl)phenyl)-4-methoxybenzenesulfonamide
CAS 176708-42-2C24H25ClN2O3S
2-(N-(2-Aminoethyl)-N-(2,4,5-trichlorobenzenesulfonyl))amino-N-(4-chlorocinnamyl)-N-methylbenzylamine chemical structure, C25H25Cl4N3O2S, CAS 176181-81-0
2-(N-(2-Aminoethyl)-N-(2,4,5-trichlorobenzenesulfonyl))amino-N-(4-chlorocinnamyl)-N-methylbenzylamine
CAS 176181-81-0C25H25Cl4N3O2S
KN-92 phosphate chemical structure, C24H28ClN2O7PS, CAS 1135280-28-2
KN-92 phosphate
CAS 1135280-28-2C24H28ClN2O7PS
KN-93 Phosphate chemical structure, C26H32ClN2O8PS, CAS 1188890-41-6
KN-93 Phosphate
CAS 1188890-41-6C26H32ClN2O8PS
KN-92 hydrochloride chemical structure, C24H26Cl2N2O3S, CAS 1431698-47-3
KN-92 hydrochloride
CAS 1431698-47-3C24H26Cl2N2O3S
KN-93 hydrochloride chemical structure, C26H30Cl2N2O4S, CAS 1956426-56-4
KN-93 hydrochloride
CAS 1956426-56-4C26H30Cl2N2O4S