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Murcko scaffold

1-Phenyl-2-((4-phenyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl)thio)ethanone scaffold

28 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
27
Chemicals
28
With full pages
15
Scaffold SMILES

O=C(CSc1nnc(-c2ccncc2)n1-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 scaffoldOpen the 1-Phenyl-2-((4-phenyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl)thio)ethanone page
Murcko scaffold O=C(CSc1nnc(-c2ccncc2)n1-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 28 of 28 chemicals

1-Phenyl-2-((4-phenyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl)thio)ethanone chemical structure, C21H16N4OS, CAS 325694-03-9
1-Phenyl-2-((4-phenyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl)thio)ethanone
CAS 325694-03-9C21H16N4OS
2-{[4-(4-Methylphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-phenylethanone chemical structure, C22H18N4OS, CAS 338425-98-2
2-{[4-(4-Methylphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-phenylethanone
CAS 338425-98-2C22H18N4OS
1-(4-ME-PH)-2-((4-(4-ME-PH)-5-(4-Pyridinyl)-4H-1,2,4-triazol-3-yl)thio)ethanone chemical structure, C23H20N4OS, CAS 338426-00-9
1-(4-ME-PH)-2-((4-(4-ME-PH)-5-(4-Pyridinyl)-4H-1,2,4-triazol-3-yl)thio)ethanone
CAS 338426-00-9C23H20N4OS
1-(4-Fluorophenyl)-2-{[4-(4-methylphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone chemical structure, C22H17FN4OS, CAS 499124-48-0
1-(4-Fluorophenyl)-2-{[4-(4-methylphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
CAS 499124-48-0C22H17FN4OS
1-(4-Bromophenyl)-2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone chemical structure, C21H15BrN4OS, CAS 610281-89-5
1-(4-Bromophenyl)-2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone
CAS 610281-89-5C21H15BrN4OS
2-((4-(4-Bromophenyl)-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl)sulfanyl)-1-(2,5-dimethoxyphenyl)ethanone chemical structure, C23H19BrN4O3S, CAS 477329-10-5
2-((4-(4-Bromophenyl)-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl)sulfanyl)-1-(2,5-dimethoxyphenyl)ethanone
CAS 477329-10-5C23H19BrN4O3S
2-{[4-(4-Chlorophenyl)-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-fluorophenyl)ethanone chemical structure, C21H14ClFN4OS, CAS 613225-72-2
2-{[4-(4-Chlorophenyl)-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-fluorophenyl)ethanone
CAS 613225-72-2C21H14ClFN4OS
2((4-(4-BR-PH)5-(4-Pyridinyl)4H-1,2,4-triazol-3-yl)thio)-1-(4-ethoxy-PH)ethanone chemical structure, C23H19BrN4O2S, CAS 477333-11-2
2((4-(4-BR-PH)5-(4-Pyridinyl)4H-1,2,4-triazol-3-yl)thio)-1-(4-ethoxy-PH)ethanone
CAS 477333-11-2C23H19BrN4O2S
2-[[4-(4-Methoxyphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]-1-phenylethanone chemical structure, C22H18N4O2S, CAS 496775-69-0
2-[[4-(4-Methoxyphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]-1-phenylethanone
CAS 496775-69-0C22H18N4O2S
2-[[4-(4-Fluorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]-1-phenylethanone chemical structure, C21H15FN4OS, CAS 333791-75-6
2-[[4-(4-Fluorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]-1-phenylethanone
CAS 333791-75-6C21H15FN4OS
1-(3-Nitrophenyl)-2-((4-phenyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl)thio)ethanone chemical structure, C21H15N5O3S, CAS 326889-65-0
1-(3-Nitrophenyl)-2-((4-phenyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl)thio)ethanone
CAS 326889-65-0C21H15N5O3S
1-(4-Chlorophenyl)-2-{[4-phenyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one chemical structure, C21H15ClN4OS, CAS 325693-94-5
1-(4-Chlorophenyl)-2-{[4-phenyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one
CAS 325693-94-5C21H15ClN4OS
1-(4-Nitrophenyl)-2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone chemical structure, C21H15N5O3S, CAS 325694-23-3
1-(4-Nitrophenyl)-2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone
CAS 325694-23-3C21H15N5O3S
1-(4-Fluorophenyl)-2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone chemical structure, C21H15FN4OS, CAS 325694-00-6
1-(4-Fluorophenyl)-2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone
CAS 325694-00-6C21H15FN4OS
1-(4-Methoxyphenyl)-2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone chemical structure, C22H18N4O2S, CAS 325694-22-2
1-(4-Methoxyphenyl)-2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone
CAS 325694-22-2C22H18N4O2S
2-((4-(4-BR-PH)-5-(4-Pyridinyl)-4H-1,2,4-triazol-3-yl)thio)-1-(4-F-PH)ethanone chemical structure, C21H14BrFN4OS, CAS 477329-76-3
2-((4-(4-BR-PH)-5-(4-Pyridinyl)-4H-1,2,4-triazol-3-yl)thio)-1-(4-F-PH)ethanone
CAS 477329-76-3C21H14BrFN4OS
1-(2,5-Dimethoxyphenyl)-2-{[4-(4-methylphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone chemical structure, C24H22N4O3S, CAS 499124-53-7
1-(2,5-Dimethoxyphenyl)-2-{[4-(4-methylphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
CAS 499124-53-7C24H22N4O3S
1-(4-Ethoxyphenyl)-2-[[4-(4-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone chemical structure, C24H22N4O2S, CAS 499124-54-8
1-(4-Ethoxyphenyl)-2-[[4-(4-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone
CAS 499124-54-8C24H22N4O2S
2-{[4-(4-Chlorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-methoxyphenyl)ethanone chemical structure, C22H17ClN4O2S, CAS 498546-23-9
2-{[4-(4-Chlorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-methoxyphenyl)ethanone
CAS 498546-23-9C22H17ClN4O2S
2-((4-(4-Bromophenyl)-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl)sulfanyl)-1-(3-methoxyphenyl)ethanone chemical structure, C22H17BrN4O2S, CAS 477330-29-3
2-((4-(4-Bromophenyl)-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl)sulfanyl)-1-(3-methoxyphenyl)ethanone
CAS 477330-29-3C22H17BrN4O2S
1-(4-Chlorophenyl)-2-{[4-(4-chlorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one chemical structure, C21H14Cl2N4OS, CAS 519150-04-0
1-(4-Chlorophenyl)-2-{[4-(4-chlorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one
CAS 519150-04-0C21H14Cl2N4OS
1-(4-Chlorophenyl)-2-{[4-(4-methylphenyl)-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone chemical structure, C22H17ClN4OS, CAS 499124-87-7
1-(4-Chlorophenyl)-2-{[4-(4-methylphenyl)-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
CAS 499124-87-7C22H17ClN4OS
2-((4-(4-CL-PH)-5-(4-Pyridinyl)-4H-1,2,4-triazol-3-yl)thio)-1-(4-ME-PH)ethanone chemical structure, C22H17ClN4OS, CAS 476483-77-9
2-((4-(4-CL-PH)-5-(4-Pyridinyl)-4H-1,2,4-triazol-3-yl)thio)-1-(4-ME-PH)ethanone
CAS 476483-77-9C22H17ClN4OS
2-((4-(4-Chlorophenyl)-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl)sulfanyl)-1-(3,4-dihydroxyphenyl)ethanone chemical structure, C21H15ClN4O3S, CAS 575466-45-4
2-((4-(4-Chlorophenyl)-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl)sulfanyl)-1-(3,4-dihydroxyphenyl)ethanone
CAS 575466-45-4C21H15ClN4O3S