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Murcko scaffold

Ring system with 4 rings and 21 atoms

7 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
21
Chemicals
7
With full pages
1
Scaffold SMILES

c1ccc(-c2cn(-c3ccccc3)c3[n+]2CCCS3)cc1

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 c1ccc(-c2cn(-c3ccccc3)c3[n+]2CCCS3)cc1

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 7 of 7 chemicals

1-(4-Methoxyphenyl)-3-(4-nitrophenyl)-6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-1-ium chemical structure, C19H18N3O3S+, CAS 783299-62-7
1-(4-Methoxyphenyl)-3-(4-nitrophenyl)-6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-1-ium
CAS 783299-62-7C19H18N3O3S+
1-Phenyl-3-p-tolyl-6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-1-ium chemical structure, C19H19BrN2S, CAS 288090-68-6
1-Phenyl-3-p-tolyl-6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-1-ium
CAS 288090-68-6C19H19BrN2S
3-(3-Nitrophenyl)-1-phenyl-6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-1-ium perchlorate chemical structure, C18H16ClN3O6S, CAS 474621-69-7
3-(3-Nitrophenyl)-1-phenyl-6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-1-ium perchlorate
CAS 474621-69-7C18H16ClN3O6S
3-(4-Bromophenyl)-1-phenyl-6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-1-ium bromide chemical structure, C18H16Br2N2S, CAS 288090-74-4
3-(4-Bromophenyl)-1-phenyl-6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-1-ium bromide
CAS 288090-74-4C18H16Br2N2S
1-(4-Methoxyphenyl)-3-(4-nitrophenyl)-6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-1-ium bromide chemical structure, C19H18BrN3O3S, CAS 475157-91-6
1-(4-Methoxyphenyl)-3-(4-nitrophenyl)-6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-1-ium bromide
CAS 475157-91-6C19H18BrN3O3S
1-(4-Bromophenyl)-3-(4-chlorophenyl)-6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-1-ium bromide chemical structure, C18H15Br2ClN2S, CAS 475158-10-2
1-(4-Bromophenyl)-3-(4-chlorophenyl)-6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-1-ium bromide
CAS 475158-10-2C18H15Br2ClN2S
3-(4-Bromophenyl)-1-(4-methoxyphenyl)-6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-1-ium bromide chemical structure, C19H18Br2N2OS, CAS 475094-83-8
3-(4-Bromophenyl)-1-(4-methoxyphenyl)-6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-1-ium bromide
CAS 475094-83-8C19H18Br2N2OS