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Murcko scaffold

Ring system with 3 rings and 21 atoms

75 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
21
Chemicals
75
With full pages
18
Scaffold SMILES

O=C(Cn1cnc2[nH]c(=O)[nH]c(=O)c21)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(Cn1cnc2[nH]c(=O)[nH]c(=O)c21)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 48 of 75 chemicals

Methyl 2-{[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetyl]amino}benzoate chemical structure, C17H17N5O5, CAS 314042-90-5
Methyl 2-{[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetyl]amino}benzoate
CAS 314042-90-5C17H17N5O5
2-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-methyl-N-phenylacetamide chemical structure, C16H17N5O3, CAS 332117-26-7
2-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-methyl-N-phenylacetamide
CAS 332117-26-7C16H17N5O3
N-(3,4-Difluorophenyl)-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide chemical structure, C15H13F2N5O3, CAS 349400-67-5
N-(3,4-Difluorophenyl)-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide
CAS 349400-67-5C15H13F2N5O3
N-(4-Cyanophenyl)-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide chemical structure, C16H14N6O3, CAS 369395-41-5
N-(4-Cyanophenyl)-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide
CAS 369395-41-5C16H14N6O3
2-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(2-fluorophenyl)acetamide chemical structure, C15H14FN5O3, CAS 314042-87-0
2-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(2-fluorophenyl)acetamide
CAS 314042-87-0C15H14FN5O3
2-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(3,4-dimethylphenyl)acetamide chemical structure, C17H19N5O3, CAS 332117-06-3
2-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(3,4-dimethylphenyl)acetamide
CAS 332117-06-3C17H19N5O3
2-(1,3-Dimethyl-2,6-dioxopurin-7-yl)-N-(3-methoxyphenyl)acetamide chemical structure, C16H17N5O4, CAS 332117-17-6
2-(1,3-Dimethyl-2,6-dioxopurin-7-yl)-N-(3-methoxyphenyl)acetamide
CAS 332117-17-6C16H17N5O4
2-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(4-fluorophenyl)acetamide chemical structure, C15H14FN5O3, CAS 332117-20-1
2-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(4-fluorophenyl)acetamide
CAS 332117-20-1C15H14FN5O3
2-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(4-methoxyphenyl)acetamide chemical structure, C16H17N5O4, CAS 332117-42-7
2-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(4-methoxyphenyl)acetamide
CAS 332117-42-7C16H17N5O4
2-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(2-methoxyphenyl)acetamide chemical structure, C16H17N5O4, CAS 332117-45-0
2-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(2-methoxyphenyl)acetamide
CAS 332117-45-0C16H17N5O4
2-(1,3-Dimethyl-2,6-dioxopurin-7-yl)-N-(2-methylphenyl)acetamide chemical structure, C16H17N5O3, CAS 332117-52-9
2-(1,3-Dimethyl-2,6-dioxopurin-7-yl)-N-(2-methylphenyl)acetamide
CAS 332117-52-9C16H17N5O3
2-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(2,4-dimethylphenyl)acetamide chemical structure, C17H19N5O3, CAS 332117-53-0
2-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(2,4-dimethylphenyl)acetamide
CAS 332117-53-0C17H19N5O3
2-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(4-ethylphenyl)acetamide chemical structure, C17H19N5O3, CAS 332117-55-2
2-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(4-ethylphenyl)acetamide
CAS 332117-55-2C17H19N5O3
N-(3-Chlorophenyl)-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide chemical structure, C15H14ClN5O3, CAS 332117-56-3
N-(3-Chlorophenyl)-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide
CAS 332117-56-3C15H14ClN5O3
N-(2,4-Difluorophenyl)-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide chemical structure, C15H13F2N5O3, CAS 332117-63-2
N-(2,4-Difluorophenyl)-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide
CAS 332117-63-2C15H13F2N5O3
2-(1,3-Dimethyl-2,6-dioxopurin-7-yl)-N-(3-fluorophenyl)acetamide chemical structure, C15H14FN5O3, CAS 332117-65-4
2-(1,3-Dimethyl-2,6-dioxopurin-7-yl)-N-(3-fluorophenyl)acetamide
CAS 332117-65-4C15H14FN5O3
2-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-ethyl-N-phenylacetamide chemical structure, C17H19N5O3, CAS 332117-54-1
2-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-ethyl-N-phenylacetamide
CAS 332117-54-1C17H19N5O3
2-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(2,6-dimethylphenyl)acetamide chemical structure, C17H19N5O3, CAS 332117-08-5
2-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(2,6-dimethylphenyl)acetamide
CAS 332117-08-5C17H19N5O3
N-(4-Chlorophenyl)-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide chemical structure, C15H14ClN5O3, CAS 332117-38-1
N-(4-Chlorophenyl)-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide
CAS 332117-38-1C15H14ClN5O3
N-[4-(Acetylamino)phenyl]-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide chemical structure, C17H18N6O4, CAS 349131-78-8
N-[4-(Acetylamino)phenyl]-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide
CAS 349131-78-8C17H18N6O4
4-{[(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetyl]amino}benzamide chemical structure, C16H16N6O4, CAS 349135-96-2
4-{[(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetyl]amino}benzamide
CAS 349135-96-2C16H16N6O4
N-{4-[(tert-Butylamino)sulfonyl]phenyl}-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide chemical structure, C19H24N6O5S, CAS 510736-27-3
N-{4-[(tert-Butylamino)sulfonyl]phenyl}-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide
CAS 510736-27-3C19H24N6O5S
2-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-[3-(trifluoromethyl)phenyl]acetamide chemical structure, C16H14F3N5O3, CAS 349400-51-7
2-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
CAS 349400-51-7C16H14F3N5O3
N-(3,4-Dichlorophenyl)-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide chemical structure, C15H13Cl2N5O3, CAS 332117-04-1
N-(3,4-Dichlorophenyl)-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide
CAS 332117-04-1C15H13Cl2N5O3