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Murcko scaffold

Ring system with 2 rings and 16 atoms

8 chemicals on CompoundList share this ring system.

Rings
2
Scaffold atoms
16
Chemicals
8
With full pages
2
Scaffold SMILES

O=S(=O)(c1ccccc1)N1C=CC=NCC1

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)(c1ccccc1)N1C=CC=NCC1

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

1-[(4-Bromophenyl)sulfonyl]-5-[chloro(difluoro)methyl]-2,3-dihydro-1H-1,4-diazepine chemical structure, C12H10BrClF2N2O2S, CAS 477848-82-1
1-[(4-Bromophenyl)sulfonyl]-5-[chloro(difluoro)methyl]-2,3-dihydro-1H-1,4-diazepine
CAS 477848-82-1C12H10BrClF2N2O2S
1-{[4-(tert-Butyl)phenyl]sulfonyl}-5-[chloro(difluoro)methyl]-2,3-dihydro-1H-1,4-diazepine chemical structure, C16H19ClF2N2O2S, CAS 439096-51-2
1-{[4-(tert-Butyl)phenyl]sulfonyl}-5-[chloro(difluoro)methyl]-2,3-dihydro-1H-1,4-diazepine
CAS 439096-51-2C16H19ClF2N2O2S
5-[Chloro(difluoro)methyl]-1-(mesitylsulfonyl)-2,3-dihydro-1H-1,4-diazepine chemical structure, C15H17ClF2N2O2S, CAS 439096-53-4
5-[Chloro(difluoro)methyl]-1-(mesitylsulfonyl)-2,3-dihydro-1H-1,4-diazepine
CAS 439096-53-4C15H17ClF2N2O2S
5-[Chloro(difluoro)methyl]-1-[(4-chlorophenyl)sulfonyl]-2,3-dihydro-1H-1,4-diazepine chemical structure, C12H10Cl2F2N2O2S, CAS 477848-83-2
5-[Chloro(difluoro)methyl]-1-[(4-chlorophenyl)sulfonyl]-2,3-dihydro-1H-1,4-diazepine
CAS 477848-83-2C12H10Cl2F2N2O2S
1-[(4-Methylphenyl)sulfonyl]-5-(trifluoromethyl)-2,3-dihydro-1H-1,4-diazepine chemical structure, C13H13F3N2O2S, CAS 478078-89-6
1-[(4-Methylphenyl)sulfonyl]-5-(trifluoromethyl)-2,3-dihydro-1H-1,4-diazepine
CAS 478078-89-6C13H13F3N2O2S
1-{[4-(tert-Butyl)phenyl]sulfonyl}-5-(trifluoromethyl)-2,3-dihydro-1H-1,4-diazepine chemical structure, C16H19F3N2O2S, CAS 478078-94-3
1-{[4-(tert-Butyl)phenyl]sulfonyl}-5-(trifluoromethyl)-2,3-dihydro-1H-1,4-diazepine
CAS 478078-94-3C16H19F3N2O2S
1-(Mesitylsulfonyl)-5-(trifluoromethyl)-2,3-dihydro-1H-1,4-diazepine chemical structure, C15H17F3N2O2S, CAS 439112-03-5
1-(Mesitylsulfonyl)-5-(trifluoromethyl)-2,3-dihydro-1H-1,4-diazepine
CAS 439112-03-5C15H17F3N2O2S
1-[(4-Bromophenyl)sulfonyl]-5-(trifluoromethyl)-2,3-dihydro-1H-1,4-diazepine chemical structure, C12H10BrF3N2O2S, CAS 478259-66-4
1-[(4-Bromophenyl)sulfonyl]-5-(trifluoromethyl)-2,3-dihydro-1H-1,4-diazepine
CAS 478259-66-4C12H10BrF3N2O2S