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Murcko scaffold

Ring system with 3 rings and 21 atoms

22 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
21
Chemicals
22
With full pages
8
Scaffold SMILES

O=C(CSc1nn2c(=O)cnnc2s1)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(CSc1nn2c(=O)cnnc2s1)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 22 of 22 chemicals

2-[(3-tert-Butyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]-N-(4-ethoxyphenyl)acetamide chemical structure, C18H21N5O3S2, CAS 328020-97-9
2-[(3-tert-Butyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]-N-(4-ethoxyphenyl)acetamide
CAS 328020-97-9C18H21N5O3S2
Methyl 4-(2-((3-(tert-butyl)-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)thio)acetamido)benzoate chemical structure, C18H19N5O4S2, CAS 540772-34-7
Methyl 4-(2-((3-(tert-butyl)-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)thio)acetamido)benzoate
CAS 540772-34-7C18H19N5O4S2
N-(3-Acetamidophenyl)-2-[(3-methyl-4-oxo-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]acetamide chemical structure, C15H14N6O3S2, CAS 869074-13-5
N-(3-Acetamidophenyl)-2-[(3-methyl-4-oxo-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]acetamide
CAS 869074-13-5C15H14N6O3S2
2-[(3-Methyl-4-oxo-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]-N-(2-methylphenyl)acetamide chemical structure, C14H13N5O2S2, CAS 869073-75-6
2-[(3-Methyl-4-oxo-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]-N-(2-methylphenyl)acetamide
CAS 869073-75-6C14H13N5O2S2
2-[(3-Methyl-4-oxo-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]-N-(4-methylphenyl)acetamide chemical structure, C14H13N5O2S2, CAS 869073-76-7
2-[(3-Methyl-4-oxo-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]-N-(4-methylphenyl)acetamide
CAS 869073-76-7C14H13N5O2S2
N-(3-Chlorophenyl)-2-[(3-methyl-4-oxo-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]acetamide chemical structure, C13H10ClN5O2S2, CAS 869073-86-9
N-(3-Chlorophenyl)-2-[(3-methyl-4-oxo-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]acetamide
CAS 869073-86-9C13H10ClN5O2S2
N-(4-Chlorophenyl)-2-[(3-methyl-4-oxo-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]acetamide chemical structure, C13H10ClN5O2S2, CAS 869073-87-0
N-(4-Chlorophenyl)-2-[(3-methyl-4-oxo-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]acetamide
CAS 869073-87-0C13H10ClN5O2S2
N-(2-Methoxyphenyl)-2-((3-methyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)thio)acetamide chemical structure, C14H13N5O3S2, CAS 869073-92-7
N-(2-Methoxyphenyl)-2-((3-methyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)thio)acetamide
CAS 869073-92-7C14H13N5O3S2
N-(3-Methoxyphenyl)-2-[(3-methyl-4-oxo-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]acetamide chemical structure, C14H13N5O3S2, CAS 869073-93-8
N-(3-Methoxyphenyl)-2-[(3-methyl-4-oxo-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]acetamide
CAS 869073-93-8C14H13N5O3S2
N-(4-Methoxyphenyl)-2-[(3-methyl-4-oxo-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]acetamide chemical structure, C14H13N5O3S2, CAS 869073-94-9
N-(4-Methoxyphenyl)-2-[(3-methyl-4-oxo-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]acetamide
CAS 869073-94-9C14H13N5O3S2
N-(3,5-Dimethylphenyl)-2-[(3-methyl-4-oxo-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]acetamide chemical structure, C15H15N5O2S2, CAS 869073-80-3
N-(3,5-Dimethylphenyl)-2-[(3-methyl-4-oxo-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]acetamide
CAS 869073-80-3C15H15N5O2S2
N-(3-Chloro-4-methylphenyl)-2-[(3-methyl-4-oxo-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]acetamide chemical structure, C14H12ClN5O2S2, CAS 869073-90-5
N-(3-Chloro-4-methylphenyl)-2-[(3-methyl-4-oxo-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]acetamide
CAS 869073-90-5C14H12ClN5O2S2
2-[(3-Methyl-4-oxo-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide chemical structure, C14H10F3N5O2S2, CAS 869074-03-3
2-[(3-Methyl-4-oxo-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide
CAS 869074-03-3C14H10F3N5O2S2
2-[(3-Methyl-4-oxo-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]-N-[4-(trifluoromethyl)phenyl]acetamide chemical structure, C14H10F3N5O2S2, CAS 869074-04-4
2-[(3-Methyl-4-oxo-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]-N-[4-(trifluoromethyl)phenyl]acetamide
CAS 869074-04-4C14H10F3N5O2S2
N-(4-Acetylphenyl)-2-[(3-methyl-4-oxo-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]acetamide chemical structure, C15H13N5O3S2, CAS 869074-12-4
N-(4-Acetylphenyl)-2-[(3-methyl-4-oxo-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]acetamide
CAS 869074-12-4C15H13N5O3S2
N-(4-Bromophenyl)-2-((3-methyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)thio)acetamide chemical structure, C13H10BrN5O2S2, CAS 869073-88-1
N-(4-Bromophenyl)-2-((3-methyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)thio)acetamide
CAS 869073-88-1C13H10BrN5O2S2
Ethyl 2-[2-({3-tert-butyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl}sulfanyl)acetamido]benzoate chemical structure, C19H21N5O4S2, CAS 896296-97-2
Ethyl 2-[2-({3-tert-butyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl}sulfanyl)acetamido]benzoate
CAS 896296-97-2C19H21N5O4S2
N-(2,5-Dimethoxyphenyl)-2-({3-methyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl}sulfanyl)acetamide chemical structure, C15H15N5O4S2, CAS 869073-98-3
N-(2,5-Dimethoxyphenyl)-2-({3-methyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl}sulfanyl)acetamide
CAS 869073-98-3C15H15N5O4S2
Methyl 4-[2-({3-methyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl}sulfanyl)acetamido]benzoate chemical structure, C15H13N5O4S2, CAS 869074-11-3
Methyl 4-[2-({3-methyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl}sulfanyl)acetamido]benzoate
CAS 869074-11-3C15H13N5O4S2
N-(3,4-Dimethoxyphenyl)-2-((3-methyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)thio)acetamide chemical structure, C15H15N5O4S2, CAS 869073-99-4
N-(3,4-Dimethoxyphenyl)-2-((3-methyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)thio)acetamide
CAS 869073-99-4C15H15N5O4S2
2-((3-Methyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)thio)-N-(4-(trifluoromethoxy)phenyl)acetamide chemical structure, C14H10F3N5O3S2, CAS 869074-06-6
2-((3-Methyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)thio)-N-(4-(trifluoromethoxy)phenyl)acetamide
CAS 869074-06-6C14H10F3N5O3S2
2-((3-Methyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)thio)-N-(3-nitrophenyl)acetamide chemical structure, C13H10N6O4S2, CAS 869074-07-7
2-((3-Methyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)thio)-N-(3-nitrophenyl)acetamide
CAS 869074-07-7C13H10N6O4S2