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Murcko scaffold

Ring system with 3 rings and 20 atoms

42 chemicals on CompoundList share this ring system.

Rings: 3
Scaffold atoms: 20
Chemicals: 42
With full pages: 4

Scaffold SMILES

O=C(CSc1nnc2ncncn12)Nc1ccccc1

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(CSc1nnc2ncncn12)Nc1ccccc1

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 42 of 42 chemicals

2-[[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide chemical structure, C17H18ClF3N8OS, CAS 749220-31-3

2-[[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide

CAS 749220-31-3C₁₇H₁₈ClF₃N₈OS

2-{[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl}-N-[4-(trifluoromethoxy)phenyl]acetamide chemical structure, C17H19F3N8O2S, CAS 749222-87-5

2-{[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl}-N-[4-(trifluoromethoxy)phenyl]acetamide

CAS 749222-87-5C₁₇H₁₉F₃N₈O₂S

2-[[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]-N-(3,5-dimethylphenyl)acetamide chemical structure, C18H24N8OS, CAS 749222-94-4

2-[[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]-N-(3,5-dimethylphenyl)acetamide

CAS 749222-94-4C₁₈H₂₄N₈OS

2-[[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]-N-[2-(difluoromethoxy)phenyl]acetamide chemical structure, C17H20F2N8O2S, CAS 749222-99-9

2-[[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]-N-[2-(difluoromethoxy)phenyl]acetamide

CAS 749222-99-9C₁₇H₂₀F₂N₈O₂S

2-{[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide chemical structure, C17H22N8O2S, CAS 522604-26-8

2-{[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide

CAS 522604-26-8C₁₇H₂₂N₈O₂S

2-[[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]-N-(2-bromo-4-methylphenyl)acetamide chemical structure, C17H21BrN8OS, CAS 721914-59-6

2-[[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]-N-(2-bromo-4-methylphenyl)acetamide

CAS 721914-59-6C₁₇H₂₁BrN₈OS

2-{[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl}-N-(3-methylphenyl)acetamide chemical structure, C17H22N8OS, CAS 537702-56-0

2-{[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl}-N-(3-methylphenyl)acetamide

CAS 537702-56-0C₁₇H₂₂N₈OS

Methyl 2-[({[5,7-bis(ethylamino)[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl}acetyl)amino]benzoate chemical structure, C18H22N8O3S, CAS 696616-05-4

Methyl 2-[({[5,7-bis(ethylamino)[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl}acetyl)amino]benzoate

CAS 696616-05-4C₁₈H₂₂N₈O₃S

2-((5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl)thio)-N-(2,4-dimethoxyphenyl)acetamide chemical structure, C18H24N8O3S, CAS 537702-68-4

2-((5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl)thio)-N-(2,4-dimethoxyphenyl)acetamide

CAS 537702-68-4C₁₈H₂₄N₈O₃S

2-{[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl}-N-(2-nitrophenyl)acetamide chemical structure, C16H19N9O3S, CAS 721406-93-5

2-{[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl}-N-(2-nitrophenyl)acetamide

CAS 721406-93-5C₁₆H₁₉N₉O₃S

2-[[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]-N-(3-chlorophenyl)acetamide chemical structure, C16H19ClN8OS, CAS 898443-49-7

2-[[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]-N-(3-chlorophenyl)acetamide

CAS 898443-49-7C₁₆H₁₉ClN₈OS

2-[[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]-N-(3-chloro-2-methylphenyl)acetamide chemical structure, C17H21ClN8OS, CAS 898449-19-9

2-[[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]-N-(3-chloro-2-methylphenyl)acetamide

CAS 898449-19-9C₁₇H₂₁ClN₈OS

2-{[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl}-N-(3-fluorophenyl)acetamide chemical structure, C16H19FN8OS, CAS 898414-60-3

2-{[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl}-N-(3-fluorophenyl)acetamide

CAS 898414-60-3C₁₆H₁₉FN₈OS

2-{[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl}-N-(2-fluorophenyl)acetamide chemical structure, C16H19FN8OS, CAS 898443-51-1

2-{[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl}-N-(2-fluorophenyl)acetamide

CAS 898443-51-1C₁₆H₁₉FN₈OS

2-{[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl}-N-(2-chlorophenyl)acetamide chemical structure, C16H19ClN8OS, CAS 898449-21-3

2-{[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl}-N-(2-chlorophenyl)acetamide

CAS 898449-21-3C₁₆H₁₉ClN₈OS

2-((5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl)thio)-N-(2,6-dimethylphenyl)acetamide chemical structure, C18H24N8OS, CAS 898414-61-4

2-((5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl)thio)-N-(2,6-dimethylphenyl)acetamide

CAS 898414-61-4C₁₈H₂₄N₈OS

2-{[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl}-N-(5-chloro-2-methylphenyl)acetamide chemical structure, C17H21ClN8OS, CAS 898449-23-5

2-{[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl}-N-(5-chloro-2-methylphenyl)acetamide

CAS 898449-23-5C₁₇H₂₁ClN₈OS

2-[[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]-N-(4-ethylphenyl)acetamide chemical structure, C18H24N8OS, CAS 898414-62-5

2-[[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]-N-(4-ethylphenyl)acetamide

CAS 898414-62-5C₁₈H₂₄N₈OS

2-[[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]-N-(3,4-dimethylphenyl)acetamide chemical structure, C18H24N8OS, CAS 898443-54-4

2-[[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]-N-(3,4-dimethylphenyl)acetamide

CAS 898443-54-4C₁₈H₂₄N₈OS

2-[[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]-N-(4-fluorophenyl)acetamide chemical structure, C16H19FN8OS, CAS 898449-25-7

2-[[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]-N-(4-fluorophenyl)acetamide

CAS 898449-25-7C₁₆H₁₉FN₈OS

2-[[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]-N-(3-chloro-4-methylphenyl)acetamide chemical structure, C17H21ClN8OS, CAS 898443-56-6

2-[[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]-N-(3-chloro-4-methylphenyl)acetamide

CAS 898443-56-6C₁₇H₂₁ClN₈OS

2-[[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]-N-(4-chlorophenyl)acetamide chemical structure, C16H19ClN8OS, CAS 898449-34-8

2-[[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]-N-(4-chlorophenyl)acetamide

CAS 898449-34-8C₁₆H₁₉ClN₈OS

2-((5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl)thio)-N-(2-ethylphenyl)acetamide chemical structure, C18H24N8OS, CAS 886902-15-4

2-((5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl)thio)-N-(2-ethylphenyl)acetamide

CAS 886902-15-4C₁₈H₂₄N₈OS

2-[[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]-N-(2,4-difluorophenyl)acetamide chemical structure, C16H18F2N8OS, CAS 898414-69-2

2-[[5,7-Bis(ethylamino)-[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl]-N-(2,4-difluorophenyl)acetamide

CAS 898414-69-2C₁₆H₁₈F₂N₈OS