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Murcko scaffold

Ring system with 4 rings and 28 atoms

8 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
28
Chemicals
8
With full pages
1
Scaffold SMILES

O=S(=O)(c1ccccc1)N1CCN(c2cccc(NCc3ccco3)c2)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 O=S(=O)(c1ccccc1)N1CCN(c2cccc(NCc3ccco3)c2)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 8 of 8 chemicals

5-[4-(Benzenesulfonyl)piperazin-1-yl]-N-(furan-2-ylmethyl)-2-nitroaniline chemical structure, C21H22N4O5S, CAS 347310-91-2
5-[4-(Benzenesulfonyl)piperazin-1-yl]-N-(furan-2-ylmethyl)-2-nitroaniline
CAS 347310-91-2C21H22N4O5S
N-(Furan-2-ylmethyl)-5-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-nitroaniline chemical structure, C22H24N4O5S, CAS 347311-33-5
N-(Furan-2-ylmethyl)-5-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-nitroaniline
CAS 347311-33-5C22H24N4O5S
5-[4-(4-Chlorophenyl)sulfonylpiperazin-1-yl]-N-(furan-2-ylmethyl)-2-nitroaniline chemical structure, C21H21ClN4O5S, CAS 347313-74-0
5-[4-(4-Chlorophenyl)sulfonylpiperazin-1-yl]-N-(furan-2-ylmethyl)-2-nitroaniline
CAS 347313-74-0C21H21ClN4O5S
N-[4-[4-[3-(Furan-2-ylmethylamino)-4-nitrophenyl]piperazin-1-yl]sulfonylphenyl]acetamide chemical structure, C23H25N5O6S, CAS 430447-11-3
N-[4-[4-[3-(Furan-2-ylmethylamino)-4-nitrophenyl]piperazin-1-yl]sulfonylphenyl]acetamide
CAS 430447-11-3C23H25N5O6S
5-[4-(4-Bromophenyl)sulfonylpiperazin-1-yl]-N-(furan-2-ylmethyl)-2-nitroaniline chemical structure, C21H21BrN4O5S, CAS 378753-10-7
5-[4-(4-Bromophenyl)sulfonylpiperazin-1-yl]-N-(furan-2-ylmethyl)-2-nitroaniline
CAS 378753-10-7C21H21BrN4O5S
5-[4-(4-Fluorophenyl)sulfonylpiperazin-1-yl]-N-(furan-2-ylmethyl)-2-nitroaniline chemical structure, C21H21FN4O5S, CAS 591726-73-7
5-[4-(4-Fluorophenyl)sulfonylpiperazin-1-yl]-N-(furan-2-ylmethyl)-2-nitroaniline
CAS 591726-73-7C21H21FN4O5S
5-[4-(3,4-Dimethylphenyl)sulfonylpiperazin-1-yl]-N-(furan-2-ylmethyl)-2-nitroaniline chemical structure, C23H26N4O5S, CAS 708241-40-1
5-[4-(3,4-Dimethylphenyl)sulfonylpiperazin-1-yl]-N-(furan-2-ylmethyl)-2-nitroaniline
CAS 708241-40-1C23H26N4O5S
5-[4-(3,4-Dimethoxyphenyl)sulfonylpiperazin-1-yl]-N-(furan-2-ylmethyl)-2-nitroaniline chemical structure, C23H26N4O7S, CAS 714279-34-2
5-[4-(3,4-Dimethoxyphenyl)sulfonylpiperazin-1-yl]-N-(furan-2-ylmethyl)-2-nitroaniline
CAS 714279-34-2C23H26N4O7S