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Murcko scaffold

Ring system with 3 rings and 21 atoms

8 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
21
Chemicals
8
With full pages
3
Scaffold SMILES

O=C(CSc1nncn1-c1ccccc1)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=C(CSc1nncn1-c1ccccc1)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

1-(4-Chlorophenyl)-2-[(5-methyl-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethan-1-one chemical structure, C17H14ClN3OS, CAS 326013-76-7
1-(4-Chlorophenyl)-2-[(5-methyl-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethan-1-one
CAS 326013-76-7C17H14ClN3OS
1-(4-Fluorophenyl)-2-[(4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethan-1-one chemical structure, C16H12FN3OS, CAS 326007-92-5
1-(4-Fluorophenyl)-2-[(4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethan-1-one
CAS 326007-92-5C16H12FN3OS
1-(4-Chlorophenyl)-2-[[4-(4-chlorophenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanone chemical structure, C17H13Cl2N3OS, CAS 663212-58-6
1-(4-Chlorophenyl)-2-[[4-(4-chlorophenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanone
CAS 663212-58-6C17H13Cl2N3OS
1-(3,5-Di-tert-BU-4-HO-PH)-2-(4-phenyl-4H-(1,2,4)triazol-3-ylsulfanyl)-ethanone chemical structure, C24H29N3O2S, CAS 143212-97-9
1-(3,5-Di-tert-BU-4-HO-PH)-2-(4-phenyl-4H-(1,2,4)triazol-3-ylsulfanyl)-ethanone
CAS 143212-97-9C24H29N3O2S
2-((4-(4-Chlorophenyl)-5-methyl-4H-1,2,4-triazol-3-yl)thio)-1-phenylethanone chemical structure, C17H14ClN3OS, CAS 618439-53-5
2-((4-(4-Chlorophenyl)-5-methyl-4H-1,2,4-triazol-3-yl)thio)-1-phenylethanone
CAS 618439-53-5C17H14ClN3OS
N-{2-[5-{[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl}-4-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]ethyl}acetamide chemical structure, C21H21BrN4O3S, CAS 6315-37-3
N-{2-[5-{[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl}-4-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]ethyl}acetamide
CAS 6315-37-3C21H21BrN4O3S
1-[4-(1-Methylethyl)phenyl]-2-[[4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]ethanone chemical structure, C20H21N3OS, CAS 1211264-91-3
1-[4-(1-Methylethyl)phenyl]-2-[[4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]ethanone
CAS 1211264-91-3C20H21N3OS
Phytoene desaturase-IN-1 chemical structure, C18H13ClF3N3O2S, CAS 2765793-54-0
Phytoene desaturase-IN-1
CAS 2765793-54-0C18H13ClF3N3O2S